methyl 3-({3-[4-(3-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 3-({3-[4-(3-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carbonyl}amino)benzoate
methyl 3-({3-[4-(3-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | F836-0631 |
| Compound Name: | methyl 3-({3-[4-(3-methylphenyl)piperazine-1-sulfonyl]thiophene-2-carbonyl}amino)benzoate |
| Molecular Weight: | 499.61 |
| Molecular Formula: | C24 H25 N3 O5 S2 |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)S(c1ccsc1C(Nc1cccc(c1)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3685 |
| logD: | 4.3678 |
| logSw: | -4.2344 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.493 |
| InChI Key: | OISAUAGLPXFZBV-UHFFFAOYSA-N |