N-(5-fluoro-2-methylphenyl)-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
N-(5-fluoro-2-methylphenyl)-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
N-(5-fluoro-2-methylphenyl)-11-methyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0259 |
| Compound Name: | N-(5-fluoro-2-methylphenyl)-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: | Cc1ccc(cc1NS(c1ccc2c(c1)C(N(C)c1c(cccn1)O2)=O)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.0673 |
| logD: | 2.867 |
| logSw: | -3.5572 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.885 |
| InChI Key: | KGIVOXKMBRMHNR-UHFFFAOYSA-N |