AC1MDCPK
dimethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: Oprea1_638348|SR-01000429679-1|F3284-0372|dimethyl 2-{[(2,4-dibromophenoxy)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|dimethyl 2-(2-(2,4-dibromophenoxy)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|3,4-DIMETHYL 2-[2-(2,4-DIBROMOPHENOXY)ACETAMIDO]-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3,4-DICARBOXYLATE|dimethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate|methyl 2-[2-(2,4-dibromophenoxy)acetylamino]-3-(methoxycarbonyl)-4,5,6-trihydr ocyclopenta[3,2-b]thiophene-4-carboxylate
| Molecular Formula | C19H17Br2NO6S |
|---|---|
| Molecular Weight | 544.9143 g/mol |
| LogP | 4.28 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 544.9143 |
| Monoisotopic Mass | 546.9123 |
| Heavy Atoms | 29 |
| Complexity | 973.84924 |
Chemical Identifiers
| CAS Number | 302802-75-1 |
|---|---|
| SMILES | COC(=O)C1CCC2=C1C(=C(S2)NC(=O)COC3=C(C=C(C=C3)Br)Br)C(=O)OC |
Product Overview
AC1MDCPK (CAS 302802-75-1), with molecular formula C19H17Br2NO6S and molecular weight 544.9143 g/mol. IUPAC: dimethyl 2-[[2-(2,4-dibromophenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.