methyl 2-{[1-(phenylmethanesulfonyl)piperidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(phenylmethanesulfonyl)piperidine-3-carbonyl]amino}benzoate
methyl 2-{[1-(phenylmethanesulfonyl)piperidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J009-0046 |
| Compound Name: | methyl 2-{[1-(phenylmethanesulfonyl)piperidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | COC(c1ccccc1NC(C1CCCN(C1)S(Cc1ccccc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3041 |
| logD: | 2.2594 |
| logSw: | -3.0634 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.344 |
| InChI Key: | UFIXJVVUZKWDNE-KRWDZBQOSA-N |