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· · COA & SDS available for every product · Same-day shipping on in-stock items ICI 162,846 , CAS No.84545-30-2
Synonyms
SR-01000597451-1 | BRD-K66782112-001-01-2 | DTXSID5020734 | HMS3675N15 | SJ96DC9C66 | Ici162,846 | ICI-162,846 | BIDD:GT0129 | Phenothiazine, 10-[3-(dimethylamino)-2-methylpropyl]- | Prestwick1_000080 | SR-01000597451 | 3-((Imino((2,2,2-trifluoroethyl)ami
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
SR-01000597451-1 | BRD-K66782112-001-01-2 | DTXSID5020734 | HMS3675N15 | SJ96DC9C66 | Ici162, 846 | ICI-162, 846 | BIDD:GT0129 | Phenothiazine, 10-[3-(dimethylamino)-2-methylpropyl]- | Prestwick1_000080 | SR-01000597451 | 3-((Imino((2, 2, 2-trifluoroethyl)ami
Biochemical and Physiological Mechanisms
A potent histamine H2receptor antagonist.
Names and Identifiers Canonical Smiles C1=CN(N=C1NC(=NCC(F)(F)F)N)CCCCC(=O)N IUPAC Name 5-[3-[[N'-(2,2,2-trifluoroethyl)carbamimidoyl]amino]pyrazol-1-yl]pentanamide InChIKey ALCSGJCIESECFD-UHFFFAOYSA-N INCHI 1S/C11H17F3N6O/c12-11(13,14)7-17-10(16)18-9-4-6-20(19-9)5-2-1-3-8(15)21/h4,6H,1-3,5,7H2,(H2,15,21)(H3,16,17,18,19) Isomeric SMILES C1=CN(N=C1NC(=NCC(F)(F)F)N)CCCCC(=O)N Molecular Weight 306.29 Reaxy-Rn 34188387 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34188387&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Imidolactams Subclass Not available Intermediate Tree Nodes Not available Direct Parent Imidolactams Alternative Parents Pyrazoles Heteroaromatic compounds Amidrazones Carboximidic acids Carboximidamides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organofluorides Imines Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aromatic heteromonocyclic compounds Substituents Imidolactam - Azole - Pyrazole - Heteroaromatic compound - Carboxylic acid amidrazone - Carboximidic acid - Carboximidic acid derivative - Carboximidamide - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Imine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as imidolactams. These are cyclic organooxygen compounds containing the structure RC(=N)N where the central carbon atom and one of the linked nitrogen atoms are part of the same ring( R here is an organyl group). They can also be viewed as analogs of lactams where the oxygen atom is replaced by a nitrogen atom. 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.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in ethanol and to 100(mM) in DMSO Molecular Weight 306.290 g/mol XLogP3 -0.100 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 8 Exact Mass 306.142 Da Monoisotopic Mass 306.142 Da Topological Polar Surface Area 111.000 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 373.000 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
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