N-{[(4-methylbenzene-1-sulfonyl)imino](phenyl)methyl}phenylalanine
Chemical Structure Depiction of
N-{[(4-methylbenzene-1-sulfonyl)imino](phenyl)methyl}phenylalanine
N-{[(4-methylbenzene-1-sulfonyl)imino](phenyl)methyl}phenylalanine
Compound characteristics
| Compound ID: | 2018-0029 |
| Compound Name: | N-{[(4-methylbenzene-1-sulfonyl)imino](phenyl)methyl}phenylalanine |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C23 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(/N=C(/c1ccccc1)NC(Cc1ccccc1)C(O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1997 |
| logD: | 0.1632 |
| logSw: | -3.4236 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.05 |
| InChI Key: | GRHKDKJXYRLNRO-NRFANRHFSA-N |