methyl 2-{[5-(4-methylpiperidine-1-sulfonyl)thiophene-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(4-methylpiperidine-1-sulfonyl)thiophene-2-carbonyl]amino}benzoate
methyl 2-{[5-(4-methylpiperidine-1-sulfonyl)thiophene-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F561-0047 |
| Compound Name: | methyl 2-{[5-(4-methylpiperidine-1-sulfonyl)thiophene-2-carbonyl]amino}benzoate |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C19 H22 N2 O5 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc(C(Nc2ccccc2C(=O)OC)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7318 |
| logD: | 3.2129 |
| logSw: | -4.01 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.535 |
| InChI Key: | PIFKKJKGVCGULK-UHFFFAOYSA-N |