N-[(2-fluorophenyl)methyl]-10-oxo-11-propyl-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
N-[(2-fluorophenyl)methyl]-10-oxo-11-propyl-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
N-[(2-fluorophenyl)methyl]-10-oxo-11-propyl-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0633 |
| Compound Name: | N-[(2-fluorophenyl)methyl]-10-oxo-11-propyl-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C22 H20 F N3 O4 S |
| Smiles: | CCCN1C(c2cc(ccc2Oc2cccnc12)S(NCc1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2534 |
| logD: | 4.2531 |
| logSw: | -4.1552 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.904 |
| InChI Key: | RGELUAVLDLEKGL-UHFFFAOYSA-N |