AC1LJZI6
2-O-methyl 4-O-propan-2-yl 5-[(2-chlorobenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: Oprea1_600452|AK-968/40707763|2-O-methyl 4-O-propan-2-yl 5-[(2-chlorobenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate|4-isopropyl 2-methyl 5-[(2-chlorobenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate|4-ISOPROPYL 2-METHYL 5-(2-CHLOROBENZAMIDO)-3-METHYLTHIOPHENE-2,4-DICARBOXYLATE|2-methyl 4-propan-2-yl 5-{[(2-chlorophenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate|methyl 5-[(2-chlorophenyl)carbonylamino]-3-methyl-4-[(methylethyl)oxycarbonyl] thiophene-2-carboxylate
| Molecular Formula | C18H18ClNO5S |
|---|---|
| Molecular Weight | 395.05942 g/mol |
| LogP | 4.31402 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.05942 |
| Monoisotopic Mass | 395.05942 |
| Heavy Atoms | 26 |
| Complexity | 859.2615 |
Chemical Identifiers
| CAS Number | 445004-63-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC=CC=C2Cl)C(=O)OC |
Product Overview
AC1LJZI6 (CAS 445004-63-7), with molecular formula C18H18ClNO5S and molecular weight 395.05942 g/mol. IUPAC: 2-O-methyl 4-O-propan-2-yl 5-[(2-chlorobenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate.
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