AC1LHVHK

methyl 2-[(2-methylfuran-3-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Also Known As: Oprea1_706853|AK-968/41926288|SR-01000255650-1|methyl 2-[(2-methyl-3-furoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-[(2-methylfuran-3-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-(2-methylfuran-3-carboxamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-[(2-methyl-3-furyl)carbonylamino]-4,5,6,7,8-pentahydrocyclohepta[1,2- b]thiophene-3-carboxylate|methyl 2-{[(2-methylfuran-3-yl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Molecular Formula	C17H19NO4S
Molecular Weight	333.1035 g/mol
LogP	3.95732
Topological Polar Surface Area	68.54 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	333.1035
Monoisotopic Mass	333.1035
Heavy Atoms	23
Complexity	743.8575

Chemical Identifiers

CAS Number	545353-93-3
SMILES	CC1=C(C=CO1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC