2-({4-[(4-ethylbenzene-1-sulfonyl)amino]-1-hydroxynaphthalen-2-yl}sulfanyl)propanoic acid
Chemical Structure Depiction of
2-({4-[(4-ethylbenzene-1-sulfonyl)amino]-1-hydroxynaphthalen-2-yl}sulfanyl)propanoic acid
2-({4-[(4-ethylbenzene-1-sulfonyl)amino]-1-hydroxynaphthalen-2-yl}sulfanyl)propanoic acid
Compound characteristics
| Compound ID: | 8018-7349 |
| Compound Name: | 2-({4-[(4-ethylbenzene-1-sulfonyl)amino]-1-hydroxynaphthalen-2-yl}sulfanyl)propanoic acid |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C21 H21 N O5 S2 |
| Smiles: | CCc1ccc(cc1)S(Nc1cc(c(c2ccccc12)O)SC(C)C(O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6611 |
| logD: | 1.4123 |
| logSw: | -4.1346 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.806 |
| InChI Key: | SSNVKVNCGLUBFR-ZDUSSCGKSA-N |