N-[(4-fluorophenyl)methyl]-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
N-[(4-fluorophenyl)methyl]-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0257 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C20 H16 F N3 O4 S |
| Smiles: | CN1C(c2cc(ccc2Oc2cccnc12)S(NCc1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8579 |
| logD: | 2.8577 |
| logSw: | -3.5788 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.691 |
| InChI Key: | ASMSRYVYPISOEN-UHFFFAOYSA-N |