Elsulfavirine
N-[4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chlorophenyl]sulfonylpropanamide
Molecular Identity
Elsulfavirine
N-[4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chlorophenyl]sulfonylpropanamide
PubChem CID: 11527519
2D Structure
Properties
C24H17BrCl2FN3O5S
Molecular Formula
629.30
Molecular Weight
g/mol
626.9433
Exact Mass
Da
5.2
XLogP
Above Lipinski threshold
134
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
977
Complexity
SMILES
Canonical SMILES
SMILES: CCC(=O)NS(=O)(=O)C1=CC(=C(C=C1)NC(=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F)ClIsomeric SMILES
SMILES: CCC(=O)NS(=O)(=O)C1=CC(=C(C=C1)NC(=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F)ClSynonyms(20)
Elsulfavirine868046-19-9elsulfavirinaZC4CGO0RUGr-1206N-[4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chlorophenyl]sulfonylpropanamideBenzeneacetamide, 4-bromo-3-(3-chloro-5-cyanophenoxy)-N-(2-chloro-4-(((1-oxopropyl)amino)sulfonyl)phenyl)-2-fluoro-N-(4-((2-(4-Bromo-3-(3-chloro-5-cyano-phenoxy)-2-fluoro-phenyl)acetyl)amino)-3-chloro-phenyl)sulfonylpropanamideelsulfavirinumN-(4-((2-(4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl)acetyl)amino)-3-chlorophenyl)sulfonylpropanamideN-[4-[[2-[4-bromo-3-(3-chloro-5-cyano-phenoxy)-2-fluoro-phenyl]acetyl]amino]-3-chloro-phenyl]sulfonylpropanamideRefChem:136555R1206N-(4-(2-(4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl)acetamido)-3-chlorobenzenesulfonyl)propanamideElsulfavirine [INN]
Data from PubChem (NCBI)
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Drug Network
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