AC1MZG2P

methyl 4-[[2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: methyl 4-{[({5-[(1-naphthylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate|methyl 4-{2-[5-(naphthylmethylthio)-1,3,4-thiadiazol-2-ylthio]acetylamino}benz oate|methyl 4-(2-((5-((naphthalen-1-ylmethyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetamido)benzoate|methyl 4-[[2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate|methyl 4-[2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate|methyl 4-{[({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate

Molecular Formula	C23H19N3O3S3
Molecular Weight	481.05887 g/mol
LogP	5.501
Topological Polar Surface Area	81.18 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	481.05887
Monoisotopic Mass	481.05887
Heavy Atoms	32
Complexity	1236.7141

Chemical Identifiers

CAS Number	613226-22-5
SMILES	COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43