ethyl N-({2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}carbamoyl)alaninate
Chemical Structure Depiction of
ethyl N-({2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}carbamoyl)alaninate
ethyl N-({2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}carbamoyl)alaninate
Compound characteristics
| Compound ID: | L366-0354 |
| Compound Name: | ethyl N-({2-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-6-yl}carbamoyl)alaninate |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C20 H22 N4 O5 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(c1ccc(C)cc1)(=O)=O)s2)NC(NC(C)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9736 |
| logD: | 3.5726 |
| logSw: | -3.9383 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.463 |
| InChI Key: | MDCOTHXWKMEKRO-ZDUSSCGKSA-N |