N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
Chemical Structure Depiction of
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide
Compound characteristics
| Compound ID: | C450-0017 |
| Compound Name: | N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)valinamide |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C24 H28 N4 O5 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(NC(C(C(C)C)NS(c1ccc3c(CCN3C(C)=O)c1)(=O)=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0878 |
| logD: | 4.0862 |
| logSw: | -4.1289 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.228 |
| InChI Key: | NOCCXEDZFCABRT-QFIPXVFZSA-N |