3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(2-chloro-4-methylphenyl)propanamide
Chemical Structure Depiction of
3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(2-chloro-4-methylphenyl)propanamide
3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(2-chloro-4-methylphenyl)propanamide
Compound characteristics
| Compound ID: | C137-0101 |
| Compound Name: | 3-(1-acetyl-5-bromo-2,3-dihydro-1H-indole-6-sulfonyl)-N-(2-chloro-4-methylphenyl)propanamide |
| Molecular Weight: | 499.81 |
| Molecular Formula: | C20 H20 Br Cl N2 O4 S |
| Smiles: | CC(N1CCc2cc(c(cc12)S(CCC(Nc1ccc(C)cc1[Cl])=O)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3186 |
| logD: | 3.3167 |
| logSw: | -3.6041 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.873 |
| InChI Key: | QKTODWQRBSMZQT-UHFFFAOYSA-N |