N-(2,3-dimethylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
N-(2,3-dimethylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | L707-0047 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | Cc1cccc(c1C)NC(CN1C(CCCc2cc(ccc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.961 |
| logD: | 3.961 |
| logSw: | -3.9828 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.478 |
| InChI Key: | WTSLMUWYCQSHRR-UHFFFAOYSA-N |