AC1MDJK2
dimethyl 2-[4-(4-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: NCGC00099158-01|SR-01000488241-1|dimethyl 2-{[4-(4-methylphenoxy)butanoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|dimethyl 2-(4-(p-tolyloxy)butanamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|dimethyl 2-[4-(4-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|methyl 3-(methoxycarbonyl)-2-[4-(4-methylphenoxy)butanoylamino]-4,5,6-trihydro cyclopenta[3,2-b]thiophene-4-carboxylate
| Molecular Formula | C22H25NO6S |
|---|---|
| Molecular Weight | 431.14026 g/mol |
| LogP | 3.84362 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 431.14026 |
| Monoisotopic Mass | 431.14026 |
| Heavy Atoms | 30 |
| Complexity | 933.84955 |
Chemical Identifiers
| CAS Number | 369398-26-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC |
Product Overview
AC1MDJK2 (CAS 369398-26-5), with molecular formula C22H25NO6S and molecular weight 431.14026 g/mol. IUPAC: dimethyl 2-[4-(4-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.