N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]valinamide
Chemical Structure Depiction of
N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]valinamide
N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]valinamide
Compound characteristics
| Compound ID: | E570-4105 |
| Compound Name: | N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]valinamide |
| Molecular Weight: | 487.57 |
| Molecular Formula: | C24 H29 N3 O6 S |
| Smiles: | CC(C)C(C(NCc1ccc2c(c1)OCO2)=O)NS(c1ccc2c(CC(C)N2C(C)=O)c1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.522 |
| logD: | 2.5215 |
| logSw: | -2.9781 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.72 |
| InChI Key: | WGUMIWMTFOKMIA-UHFFFAOYSA-N |