GW-813893
(E)-2-(5-chlorothiophen-2-yl)-N-[(3S)-1-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-2-oxopyrrolidin-3-yl]ethenesulfonamide
Molecular Identity
GW-813893
(E)-2-(5-chlorothiophen-2-yl)-N-[(3S)-1-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-2-oxopyrrolidin-3-yl]ethenesulfonamide
PubChem CID: 9911502
2D Structure
Properties
C17H22ClN3O5S2
Molecular Formula
448.00
Molecular Weight
g/mol
447.0689
Exact Mass
Da
1.2
XLogP
Drug-like (Lipinski: < 5)
133
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
7
H-Bond Acceptors
721
Complexity
SMILES
Canonical SMILES
SMILES: CC(C(=O)N1CCOCC1)N2CCC(C2=O)NS(=O)(=O)C=CC3=CC=C(S3)ClIsomeric SMILES
SMILES: C[C@@H](C(=O)N1CCOCC1)N2CC[C@@H](C2=O)NS(=O)(=O)/C=C/C3=CC=C(S3)ClSynonyms(20)
478644-12-1GW-8138931Y3JD5PEMSGW8138934-((2S)-2-((3S)-3-((((E)-2-(5-Chloro-2-thienyl)ethenyl)sulfonyl)amino)-2-oxo-1-pyrrolidinyl)-1-oxopropyl)-morpholineGW 813893RefChem:783287(1E)-2-(5-chlorothiophen-2-yl)-N-((3S)-1-((2S)-1-(morpholin-4-yl)-1-oxopropan-2-yl)-2-oxopyrrolidin-3-yl)ethene-1-sulfonamideUNII-1Y3JD5PEMSCHEMBL2200502-(5-Chloro-2-Thienyl)-N-{(3s)-1-[(1s)-1-Methyl-2-Morpholin-4-Yl-2-Oxoethyl]-2-Oxopyrrolidin-3-Yl}ethenesulfonamide(E)-2-(5-chlorothiophen-2-yl)-N-[(3S)-1-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-2-oxopyrrolidin-3-yl]ethenesulfonamideCas registry number 478644-12-1 ~16~7 C17 H22 Cl N3 O5 S2 ethenesulfonamide, 2-(5-chloro-2-thienyl)-N-((3S)-1-((1S)-1-methyl-2-(4-morpholinyl)-2-oxoethyl)-2-oxo-3-pyrrolidinyl)-, (1E)-2uwlACEFOQMQINFMRW-DYCFVMESSA-N
Data from PubChem (NCBI)
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Drug Network
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