11-ethyl-N-[(4-fluorophenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
11-ethyl-N-[(4-fluorophenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
11-ethyl-N-[(4-fluorophenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0405 |
| Compound Name: | 11-ethyl-N-[(4-fluorophenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 427.45 |
| Molecular Formula: | C21 H18 F N3 O4 S |
| Smiles: | CCN1C(c2cc(ccc2Oc2cccnc12)S(NCc1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4724 |
| logD: | 3.4722 |
| logSw: | -3.8721 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.651 |
| InChI Key: | YASKRRITRCGLSJ-UHFFFAOYSA-N |