methyl 4-({3-[methyl(4-methylbenzene-1-sulfonyl)amino]thiophene-2-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({3-[methyl(4-methylbenzene-1-sulfonyl)amino]thiophene-2-carbonyl}amino)benzoate
methyl 4-({3-[methyl(4-methylbenzene-1-sulfonyl)amino]thiophene-2-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | L876-0297 |
| Compound Name: | methyl 4-({3-[methyl(4-methylbenzene-1-sulfonyl)amino]thiophene-2-carbonyl}amino)benzoate |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C21 H20 N2 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N(C)c1ccsc1C(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5605 |
| logD: | 4.56 |
| logSw: | -4.3284 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.042 |
| InChI Key: | LDHWNKRFGUKOBC-UHFFFAOYSA-N |