N-(3-chloro-4-fluorophenyl)-10-methoxypyrido[2,3-b][1,4]benzoxazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-10-methoxypyrido[2,3-b][1,4]benzoxazepine-5(6H)-carboxamide
N-(3-chloro-4-fluorophenyl)-10-methoxypyrido[2,3-b][1,4]benzoxazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | E987-0201 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-10-methoxypyrido[2,3-b][1,4]benzoxazepine-5(6H)-carboxamide |
| Molecular Weight: | 399.81 |
| Molecular Formula: | C20 H15 Cl F N3 O3 |
| Smiles: | COc1cccc2CN(C(Nc3ccc(c(c3)[Cl])F)=O)c3cccnc3Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.6198 |
| logD: | 4.6186 |
| logSw: | -4.8834 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.811 |
| InChI Key: | FZNRCDFJFDUKAC-UHFFFAOYSA-N |