N,N′-Dicyclohexyl-4-morpholinecarboxamidine - ≥98% , CAS No.4975-73-9

CAS: 4975-73-9 Cat. No.: D105651 Peso molecular: 293.45 Número EC: 225-622-1

GRADE & PURITY ≥98%

Synonyms

Morpholine-4-methanamine, N-cyclohexyl-.alpha.-(cyclohexylimino)- | 4-Morpholinecarboximidamide,N'-dicyclohexyl- | N,N`-Dicyclohexyl-4-morpholine carboxamidine | N,N'-Dicyclohexyl-morpholine-4-carboxamidine | N,N'-Dicyclohexylmorpholine-4-carboxamidine |

Storage

Room temperature

Shipped In

Normal

Descripción general

N,N′-Dicyclohexyl-4-morpholinecarboxamidine is kidney-selective ATP-sensitive potassium blocker. It is an an orally effective nonkaliuretic diuretic in rats
N,N′-Dicyclohexyl-4-morpholinecarboxamidine was used as reagent in the synthesis of alkoxyalkyl analogs of nucleotide phosphonates, cidofovir and cyclic cidofovir

Specifications

Sinónimos

Morpholine-4-methanamine, N-cyclohexyl-.alpha.-(cyclohexylimino)- | 4-Morpholinecarboximidamide, N'-dicyclohexyl- | N, N`-Dicyclohexyl-4-morpholine carboxamidine | N, N'-Dicyclohexyl-morpholine-4-carboxamidine | N, N'-Dicyclohexylmorpholine-4-carboxamidine |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488182667
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182667
• Sonrisas canónicas: C1CCC(CC1)NC(=NC2CCCCC2)N3CCOCC3
• IUPAC Name: N,N'-dicyclohexylmorpholine-4-carboximidamide
• InChIKey: OZNYZQOTXQSUJM-UHFFFAOYSA-N
• INCHI: 1S/C17H31N3O/c1-3-7-15(8-4-1)18-17(20-11-13-21-14-12-20)19-16-9-5-2-6-10-16/h15-16H,1-14H2,(H,18,19)
• Isómeros SMILES: C1CCC(CC1)NC(=NC2CCCCC2)N3CCOCC3
• WGK Alemania: 3
• RTECS: LQ4566500
• Peso molecular: 293.45
• Reaxy-Rn: 1080037
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1080037&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Oxazinanes
      • Subclass Morpholines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Morpholines
• Alternative Parents: Guanidines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Dialkyl ethers Carboximidamides Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - Guanidine - Dialkyl ether - Ether - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as morpholines. These are organic compounds containing a morpholine moiety, which consists of a six-member aliphatic saturated ring with the formula C4H9NO, where the oxygen and nitrogen atoms lie at positions 1 and 4, respectively.
• 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)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Chloroform solubility: 25MG/ML CHCL3; Double in metal
• Punto de fusión (°C): 105-107°C
• Peso molecular: 293.400 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 293.247 Da
• Monoisotopic Mass: 293.247 Da
• Topological Polar Surface Area: 36.900 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 327.000
• 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: 1