N-(2,5-difluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
N-(2,5-difluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
Compound ID: | P619-0414 |
Compound Name: | N-(2,5-difluorophenyl)-11-ethyl-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
Molecular Weight: | 431.42 |
Molecular Formula: | C20 H15 F2 N3 O4 S |
Smiles: | CCN1C(c2cc(ccc2Oc2cccnc12)S(Nc1cc(ccc1F)F)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6386 |
logD: | 2.2079 |
logSw: | -3.9895 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.844 |
InChI Key: | BSMBFYRQYNLMNY-UHFFFAOYSA-N |