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Levemopamil

HCID 72027
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
101238-51-1
Standard SMILES
CC(C)[C@@](C#N)(CCCN(C)CCc1ccccc1)c1ccccc1
InChIKey
DWAWDSVKAUWFHC-QHCPKHFHSA-N
Molecular formula
C23H30N2
Average molar mass
334.5 g/mol
Monoisotopic mass
334.24089897

Names & identifiers

Preferred name
Levemopamil
IUPAC
(2S)-5-[methyl(2-phenylethyl)amino]-2-phenyl-2-propan-2-ylpentanenitrile
English name
Levemopamil
Molecular formula
C23H30N2
Molecular weight
334.504

Names & synonyms

Levemopamil101238-51-1LevemopamiloEmopamil, (s)-LevemopamilumTDE8767O88DTXSID00883092RefChem:153190DTXCID101022672Levemopamil [INN]CHEMBL187829(2S)-5-[methyl(2-phenylethyl)amino]-2-phenyl-2-propan-2-ylpentanenitrile
Show more names
S-Emopamil(S)-Emopamil(S)-α-(1-Methylethyl)-α-[3-[methyl(2-phenylethyl)amino]propyl]benzeneacetonitrileBenzeneacetonitrile, α-(1-methylethyl)-α-[3-[methyl(2-phenylethyl)amino]propyl]-, (αS)-
(-)-(S)-2-Isopropyl-5-(methylphenethylamino)-2-phenylvaleronitrileLevemopamilum [INN-Latin]Levemopamilo [INN-Spanish]SCHEMBL51113UNII-TDE8767O88orb1702043DWAWDSVKAUWFHC-QHCPKHFHSA-N(S)-2-isopropyl-5-(methyl(phenethyl)amino)-2-phenylpentanenitrile

Database identifiers

CAS
101238-51-1
PubChem CID
72027
DTXSID
DTXSID00883092
ChEMBL
CHEMBL187829
UNII
TDE8767O88
Nikkaji
J386.727G

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
27 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
25
Formal charge
0
Complexity
409

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Physicochemical properties

FDA UNII
8767 O88 · TDE8767O88

Chemistry & industry

Pharmacology

MeSH Pharmacological ClassificationA class of drugs that act by selective inhibition of calcium influx through cellular membranes.

Suppliers4 total

上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]

Related reactions

1 records
New reaction record
HRID 728595 reaction equation
HRID 728595As reactantuspto-grants-1991_09

Compound notes

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