methyl 4-{[N-(4-methylbenzene-1-sulfonyl)phenylalanyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[N-(4-methylbenzene-1-sulfonyl)phenylalanyl]amino}benzoate
methyl 4-{[N-(4-methylbenzene-1-sulfonyl)phenylalanyl]amino}benzoate
Compound characteristics
| Compound ID: | 1683-6928 |
| Compound Name: | methyl 4-{[N-(4-methylbenzene-1-sulfonyl)phenylalanyl]amino}benzoate |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C24 H24 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(NC(Cc1ccccc1)C(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7369 |
| logD: | 4.7333 |
| logSw: | -4.5877 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.106 |
| InChI Key: | XHCIDEUCGZKIKB-QFIPXVFZSA-N |