N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-nitro-1,3-thiazol-2-yl)valinamide
Chemical Structure Depiction of
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-nitro-1,3-thiazol-2-yl)valinamide
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-nitro-1,3-thiazol-2-yl)valinamide
Compound characteristics
| Compound ID: | C450-0128 |
| Compound Name: | N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-nitro-1,3-thiazol-2-yl)valinamide |
| Molecular Weight: | 467.52 |
| Molecular Formula: | C18 H21 N5 O6 S2 |
| Smiles: | CC(C)C(C(Nc1ncc([N+]([O-])=O)s1)=O)NS(c1ccc2c(CCN2C(C)=O)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6861 |
| logD: | 0.5975 |
| logSw: | -3.1719 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 125.644 |
| InChI Key: | KIIOIPJSNBUULA-INIZCTEOSA-N |