N,N-dimethyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
N,N-dimethyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide
Compound characteristics
| Compound ID: | M250-0357 |
| Compound Name: | N,N-dimethyl-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-sulfonamide |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C16 H23 N3 O4 S |
| Smiles: | CN(C)S(N1CCOc2ccc(cc2C1)C(N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0034 |
| logD: | 1.0034 |
| logSw: | -2.3236 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.266 |
| InChI Key: | AFWGBMLNBITRPZ-UHFFFAOYSA-N |