N-(3-chloro-4-fluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
N-(3-chloro-4-fluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0409 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 447.87 |
| Molecular Formula: | C20 H15 Cl F N3 O4 S |
| Smiles: | CCN1C(c2cc(ccc2Oc2cccnc12)S(Nc1ccc(c(c1)[Cl])F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2123 |
| logD: | 2.8661 |
| logSw: | -4.5736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.542 |
| InChI Key: | SKLREDJCJMXMNO-UHFFFAOYSA-N |