ethyl N-{[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}alaninate
Chemical Structure Depiction of
ethyl N-{[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}alaninate
ethyl N-{[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}alaninate
Compound characteristics
| Compound ID: | M072-0510 |
| Compound Name: | ethyl N-{[2-(propane-2-sulfonyl)-1,3-benzothiazol-6-yl]carbamoyl}alaninate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C16 H21 N3 O5 S2 |
| Smiles: | CCOC(C(C)NC(Nc1ccc2c(c1)sc(n2)S(C(C)C)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7628 |
| logD: | 2.7628 |
| logSw: | -3.4534 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.32 |
| InChI Key: | YRDIUYQJZSNSCE-JTQLQIEISA-N |