AC1LO5FK

4-[[2-[[5-(furan-2-yl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid

Also Known As: CBKinase1_012338|CBKinase1_024738|BRD-K78786936-001-01-3|4-[({[5-(2-furyl)-4-(1-naphthyl)-4H-1,2,4-triazol-3-yl]thio}acetyl)amino]benzoic acid|4-(2-((5-(furan-2-yl)-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoic acid|4-[({[5-(furan-2-yl)-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid|4-[[2-[[5-(2-furyl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic Acid|4-[[2-[[5-(furan-2-yl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoic acid

Molecular Formula	C25H18N4O4S
Molecular Weight	470.1049 g/mol
LogP	5.1095
Topological Polar Surface Area	110.25 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	470.1049
Monoisotopic Mass	470.1049
Heavy Atoms	34
Complexity	1471.6444

Chemical Identifiers

CAS Number	836664-19-8
SMILES	C1=CC=C2C(=C1)C=CC=C2N3C(=NN=C3SCC(=O)NC4=CC=C(C=C4)C(=O)O)C5=CC=CO5