N-(2-chloro-4-methylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
N-(2-chloro-4-methylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | L707-0105 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide |
| Molecular Weight: | 475.99 |
| Molecular Formula: | C23 H26 Cl N3 O4 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(CCCc2cc(ccc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0544 |
| logD: | 4.054 |
| logSw: | -4.2571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.478 |
| InChI Key: | SXSJRGARBCHMCY-UHFFFAOYSA-N |