General Information of the Compound
| Compound ID |
CP0077731
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| Compound Name |
(+)-cis-Diltiazem
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| Synonyms |
(+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester
(2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate
(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
(2S,3S)-5-[2-(dimethylamino)ethyl]-2-[4-(methyloxy)phenyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
(2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
Acalix
Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester
Adizem
Adizem (TN)
Aldizem
Altiazem (TN)
Angiozem (TN)
Angizem (TN)
Angizem CD (TN)
Anoheal
Apo-Diltiaz
Cardil
Cardizem
Cardizem (Hydrochloride)
Cardizem (TN)
Cardizen LA
Cartia XT (TN)
Citizem
D-cis-Diltiazem
Dilacor
Dilacor-XR
Dilatam (TN)
Dilatem (TN)
Dilcardia (TN)
Dilcontin
Dilcontin SR (TN)
Dilren
Dilt-cd
Dilta-Hexal
Diltelan (TN)
Diltia
Diltiazem
Diltiazem (INN)
Diltiazem [INN:BAN]
Diltiazemum
Diltiazemum [INN-Latin]
Dilticard
Diltime (TN)
Diltzac
Dilzem (TN)
Dilzen
Dyalec (TN)
Endrydil
Filazem (TN)
Herben (TN)
Incoril AP
MK-793 (Malate)
Nu-Diltiaz
Progor (TN)
RG 83606 (Hydrochloride)
Surazem (TN)
Tiamate (TN)
Tiazac (TN)
Tiazac Tildiem
Tiazac XC
Tiazac XC (TN)
Tildiem (TN)
Vasmulax (TN)
Viazem
Viazem (TN)
Zandil (TN)
Zemtrial (TN)
[(2S,3S)-5-(2-dimethylaminoethyl)-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate
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| Structure |
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| Formula |
C22H26N2O4S
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| Molecular Weight |
414.527
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| Canonical SMILES |
COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O
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| InChI |
InChI=1S/C22H26N2O4S/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/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1
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| InChIKey |
HSUGRBWQSSZJOP-RTWAWAEBSA-N
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| CAS |
42399-41-7
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01546, ATP-dependent translocase ABCB1
Cell-based Assay
Protein ID: PT00986, Cytochrome P450 3A4
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT03795, Solute carrier family 22 member 1
Protein ID: PT01102, Voltage-dependent L-type calcium channel subunit alpha-1C
Clinical Information about the Compound