AC1MDGO4

dimethyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Also Known As: CBMicro_040043|MixCom6_002027|Oprea1_787471|Oprea1_823529|BIM-0039994.P001|dimethyl 2-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|3,4-DIMETHYL 2-[2-(1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOL-2-YL)ACETAMIDO]-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3,4-DICARBOXYLATE|dimethyl 2-(2-(1,3-dioxoisoindolin-2-yl)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|dimethyl 2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|methyl 2-[2-(1,3-dioxobenzo[c]azolin-2-yl)acetylamino]-3-(methoxycarbonyl)-4,5 ,6-trihydrocyclopenta[3,2-b]thiophene-4-carboxylate

Molecular Formula	C21H18N2O7S
Molecular Weight	442.08347 g/mol
LogP	1.9722
Topological Polar Surface Area	119.08 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	5
Exact Mass	442.08347
Monoisotopic Mass	442.08347
Heavy Atoms	31
Complexity	1101.7432

Chemical Identifiers

CAS Number	302802-86-4
SMILES	COC(=O)C1CCC2=C1C(=C(S2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O)C(=O)OC