N-[2-(azepan-1-yl)ethyl]-2-[(2-chlorophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-[(2-chlorophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N-[2-(azepan-1-yl)ethyl]-2-[(2-chlorophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F389-0541 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-[(2-chlorophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C24 H26 Cl N3 O3 |
| Smiles: | C1CCCN(CC1)CCNC(c1ccc2c(c1)NC(/C(=C/c1ccccc1[Cl])O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1927 |
| logD: | 3.216 |
| logSw: | -4.5356 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.376 |
| InChI Key: | JGUJQSFXVPKOJU-UHFFFAOYSA-N |