AC1MUODS

N-[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide

Also Known As: ChemDiv1_014306|Oprea1_223545|HMS627K06|SR-01000565935-1|F0509-2475|4-methyl-3-nitro-N-(5-{[2-oxo-2-(1,2,3,4-tetrahydroquinolin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide|N-(5-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-methyl-3-nitrobenzamide|N-[5-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitrobenzamide

Molecular Formula	C21H19N5O4S2
Molecular Weight	469.08786 g/mol
LogP	4.07852
Topological Polar Surface Area	118.33 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	469.08786
Monoisotopic Mass	469.08786
Heavy Atoms	32
Complexity	1196.438

Chemical Identifiers

CAS Number	389072-85-9
SMILES	CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)N3CCCC4=CC=CC=C43)[N+](=O)[O-]