N,N-dimethyl-7-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-7-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
N,N-dimethyl-7-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
Compound characteristics
| Compound ID: | S629-2534 |
| Compound Name: | N,N-dimethyl-7-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide |
| Molecular Weight: | 381.49 |
| Molecular Formula: | C18 H27 N3 O4 S |
| Smiles: | CN(C)S(N1CCOc2ccc(CCC(N3CCCC3)=O)cc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6228 |
| logD: | 1.6228 |
| logSw: | -2.485 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.739 |
| InChI Key: | ZAUWDETYBLWDHJ-UHFFFAOYSA-N |