DILTIAZEM MALATE

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Trade Names:
Synonyms:
Status: Approved (1996)
Entry Type: Small molecule
Molecule Category: Salt
UNII: 14Y6444DRP
Parent Compound: DILTIAZEM

Structure
InChI Key IUSFTUWHKCSCDY-BHDTVMLSSA-N
Smile COc1ccc([C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc1.O=C(O)CC(O)C(=O)O
InChI
InChI=1S/C22H26N2O4S.C4H6O5/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3;5-2(4(8)9)1-3(6)7/h5-12,20-21H,13-14H2,1-4H3;2,5H,1H2,(H,6,7)(H,8,9)/t20-,21+;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H32N2O9S
Molecular Weight 548.61
AlogP 3.37
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 59.08
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 29.0

Pharmacology

Action Mechanism of Action Reference
BLOCKER Voltage-gated L-type calcium channel blocker DailyMed Wikipedia Wikipedia Wikipedia Wikipedia

Related Entries

Scaffolds

Parent
Mixture

Cross References

Resources Reference
ChEMBL CHEMBL1200805
FDA SRS 14Y6444DRP
PubChem 3037122
SureChEMBL SCHEMBL120772
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