3-(azepan-1-yl)-N-ethyl-N,8-dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-(azepan-1-yl)-N-ethyl-N,8-dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-(azepan-1-yl)-N-ethyl-N,8-dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
Compound ID: | J030-1148 |
Compound Name: | 3-(azepan-1-yl)-N-ethyl-N,8-dimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
Molecular Weight: | 443.56 |
Molecular Formula: | C23 H29 N3 O4 S |
Smiles: | CCN(C)S(c1cc2C(Nc3cc(C)ccc3Oc2cc1N1CCCCCC1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5429 |
logD: | 4.4968 |
logSw: | -4.3052 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.383 |
InChI Key: | QTHMHUHPOWEEQN-UHFFFAOYSA-N |