Lomerizine Dihydrochloride - ≥98% , CAS No.101477-54-7

CAS: 101477-54-7 Cat. No.: L157774 Peso molecular: 541.46 Número EC: 686-037-9 PubChem CID: 122125

GRADE & PURITY ≥98%

Synonyms

101477-54-7, 101477-55-8(free base) | Tox21_112172 | Lomerizine Dihydrochloride, 98% | Terranas (TN) | DTXCID9026427 | s1082 | BCP12061 | LOMERIZINE 2HCL | NCGC00164543-02 | FT-0627971 | D02633 | NCGC00164543-01 | Q27258118 | 1-(2,3,4-Trimethoxybenzyl)-4-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

101477-54-7, 101477-55-8(free base) | Tox21_112172 | Lomerizine Dihydrochloride, 98% | Terranas (TN) | DTXCID9026427 | s1082 | BCP12061 | LOMERIZINE 2HCL | NCGC00164543-02 | FT-0627971 | D02633 | NCGC00164543-01 | Q27258118 | 1-(2, 3, 4-Trimethoxybenzyl)-4-

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

Ca 2+ channel blocker. Inhibits voltage-activated inward calcium currents. Shows vasodilatory and neuroprotective effects against ischemic injury in vivo . Orally active.

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nota

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: COC1=C(C(=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)OC)OC.Cl.Cl
• IUPAC Name: 1-[bis(4-fluorophenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine;dihydrochloride
• InChIKey: LOGVKVSFYBBUAJ-UHFFFAOYSA-N
• INCHI: 1S/C27H30F2N2O3.2ClH/c1-32-24-13-8-21(26(33-2)27(24)34-3)18-30-14-16-31(17-15-30)25(19-4-9-22(28)10-5-19)20-6-11-23(29)12-7-20;;/h4-13,25H,14-18H2,1-3H3;2*1H
• Isómeros SMILES: COC1=C(C(=C(C=C1)CN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)OC)OC.Cl.Cl
• WGK Alemania: 3
• RTECS: TK9189000
• PubChem CID: 122125
• Peso molecular: 541.46

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Phenylmethylamines Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers N-alkylpiperazines Aralkylamines Fluorobenzenes Aryl fluorides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organofluorides Organopnictogen compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Diphenylmethane - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Phenoxy compound - Aralkylamine - N-alkylpiperazine - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl halide - Piperazine - Aryl fluoride - 1,4-diazinane - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Ether - Hydrochloride - Organohalogen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Amine - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (no humanos)

Pseudomonas aeruginosa (123386 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Klebsiella pneumoniae (43867 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Staphylococcus aureus (210822 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Acinetobacter baumannii (41033 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Escherichia coli (133304 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Cryptococcus neoformans (21258 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Candida albicans (78123 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: ≥ 24.1mg/mL in DMSO with gentle warming
• Sensibilidad: Hygroscopic,Heat Sensitive
• Punto de fusión (°C): 180 °C(dec.)
• Peso molecular: 541.500 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 540.176 Da
• Monoisotopic Mass: 540.176 Da
• Topological Polar Surface Area: 34.200 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 568.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3

Referencias

1. Yi Zhang, Ying Guo, Wenxi He, Yaping Zhao, Zhaode Feng, Mengjiao Shi, Xinyan Li, Liangwen Yan, Jiayi Xu, Kailing Hu, Rongrong Liu, Yinggang Zhang, Gang Wang, Hao Li, Pengfei Liu.  (2025)  Deciphering the rules of disulfidptosis: a genome-wide signature for identifying disulfidptosis-related genes and analyzing hepatocellular carcinoma chemotherapy sensitivities.  FREE RADICAL BIOLOGY AND MEDICINE,      [PMID:41138962] [10.1016/j.freeradbiomed.2025.10.278]