N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}valinamide
Chemical Structure Depiction of
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}valinamide
N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}valinamide
Compound characteristics
| Compound ID: | C450-0258 |
| Compound Name: | N~2~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}valinamide |
| Molecular Weight: | 514.69 |
| Molecular Formula: | C27 H38 N4 O4 S |
| Smiles: | CCN(CCCNC(C(C(C)C)NS(c1ccc2c(CCN2C(C)=O)c1)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6445 |
| logD: | 3.6119 |
| logSw: | -3.843 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.497 |
| InChI Key: | QGZKDBSKQPLWAT-SANMLTNESA-N |