 Home > Encyclopedia > N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine

N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine

N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine structure

CAS No:
144301-94-0
Formula:
C20H18ClN5O2
Chemical Name:
N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine
Synonyms:
Guanidine,N-(4-chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]-;Guanidine,N-(4-chlorophenyl)-N′-cyano-N′′-(6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl)-,(3S-trans)-;N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine;BMS 180448

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N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine Basic Attributes

Molecular Weight：

395.8 g/mol

Exact Mass：

395.84

UNII：

9B1I77MS94

Characteristics

PSA：

114 Å²

Drug Information

MeSH：

Agents that have a strengthening effect on the heart or that can increase cardiac output. They may be CARDIAC GLYCOSIDES; SYMPATHOMIMETICS; or other drugs. They are used after MYOCARDIAL INFARCT; CARDIAC SURGICAL PROCEDURES; in SHOCK; or in congestive heart failure (HEART FAILURE). (See all compounds classified as Cardiotonic Agents.)|Drugs used to cause dilation of the blood vessels. (See all compounds classified as Vasodilator Agents.)

MeSH Entry Terms：

1-(4-chlorophenyl)-3-cyano-2-((3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-4-yl)guanidine

Computed Properties

Molecular Weight:395.8
XLogP3:3.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:395.1149025
Monoisotopic Mass:395.1149025
Topological Polar Surface Area:114
Heavy Atom Count:28
Complexity:685
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: pyrophosphate formula; dinitrogen trioxide; smz tmp drug; feno33; lead oxide; structural formula for adenosine.

Guide of N-(4-Chlorophenyl)-N′-cyano-N′′-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]guanidine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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