N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-benzylvalinamide
Chemical Structure Depiction of
N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-benzylvalinamide
N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-benzylvalinamide
Compound characteristics
| Compound ID: | E570-4221 |
| Compound Name: | N~2~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-benzylvalinamide |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C23 H29 N3 O4 S |
| Smiles: | CC(C)C(C(NCc1ccccc1)=O)NS(c1ccc2c(CC(C)N2C(C)=O)c1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6089 |
| logD: | 2.6084 |
| logSw: | -3.1233 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.604 |
| InChI Key: | LUHUMGAGVRKHGA-UHFFFAOYSA-N |