Pilaralisib
2-amino-N-[3-[[3-(2-chloro-5-methoxyanilino)quinoxalin-2-yl]sulfamoyl]phenyl]-2-methylpropanamide
Molecular Identity
Pilaralisib
2-amino-N-[3-[[3-(2-chloro-5-methoxyanilino)quinoxalin-2-yl]sulfamoyl]phenyl]-2-methylpropanamide
PubChem CID: 56599306
2D Structure
Properties
C25H25ClN6O4S
Molecular Formula
541.00
Molecular Weight
g/mol
540.1347
Exact Mass
Da
3.4
XLogP
Drug-like (Lipinski: < 5)
157
TPSA
May have limited oral absorption
4
H-Bond Donors
9
H-Bond Acceptors
887
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=C(C=CC(=C4)OC)Cl)NIsomeric SMILES
SMILES: CC(C)(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=C(C=CC(=C4)OC)Cl)NSynonyms(20)
Pilaralisib934526-89-3XL-147SAR245408SAR-2454082-Amino-n-(3-(N-(3-((2-chloro-5-methoxyphenyl)amino)quinoxalin-2-yl)sulfamoyl)phenyl)-2-methylpropanamideSAR 24540860ES45KTMK2-amino-N-[3-({3-[(2-chloro-5-methoxyphenyl)amino]quinoxalin-2-yl}sulfamoyl)phenyl]-2-methylpropanamide2-Amino-N-[3-[N-[3-[(2-chloro-5-methoxyphenyl)amino]quinoxalin-2-yl]sulfamoyl]phenyl]-2-methylpropanamidepilaralisibum2-amino-N-(3-((3-((2-chloro-5-methoxyphenyl)amino)quinoxalin-2-yl)sulfamoyl)phenyl)-2-methylpropanamideRefChem:863281N-(3-(2,1,3-benzothiadiazol-6-ylamino)quinoxalin-2-yl)-4-methylbenzenesulfonamideXL 147
Data from PubChem (NCBI)
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