3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(3-acetylphenyl)propanamide
Chemical Structure Depiction of
3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(3-acetylphenyl)propanamide
3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(3-acetylphenyl)propanamide
Compound characteristics
| Compound ID: | C137-0113 |
| Compound Name: | 3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(3-acetylphenyl)propanamide |
| Molecular Weight: | 493.37 |
| Molecular Formula: | C21 H21 Br N2 O5 S |
| Smiles: | CC(c1cccc(c1)NC(CCS(c1cc2c(CCN2C(C)=O)cc1[Br])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3356 |
| logD: | 2.3347 |
| logSw: | -2.9319 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.397 |
| InChI Key: | JYRDJBPOIAJTBG-UHFFFAOYSA-N |