2-{[1-(4-methylbenzene-1-sulfonyl)-5-oxoprolyl]amino}benzoic acid
Chemical Structure Depiction of
2-{[1-(4-methylbenzene-1-sulfonyl)-5-oxoprolyl]amino}benzoic acid
2-{[1-(4-methylbenzene-1-sulfonyl)-5-oxoprolyl]amino}benzoic acid
Compound characteristics
| Compound ID: | 8015-8667 |
| Compound Name: | 2-{[1-(4-methylbenzene-1-sulfonyl)-5-oxoprolyl]amino}benzoic acid |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C19 H18 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(N1C(CCC1=O)C(Nc1ccccc1C(O)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6876 |
| logD: | -1.7254 |
| logSw: | -3.3344 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.017 |
| InChI Key: | MQDIUYQLALOXSL-INIZCTEOSA-N |