2-[(3-chlorophenyl)methylidene]-N-{2-[cyclohexyl(methyl)amino]ethyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-N-{2-[cyclohexyl(methyl)amino]ethyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
2-[(3-chlorophenyl)methylidene]-N-{2-[cyclohexyl(methyl)amino]ethyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | F389-0744 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-N-{2-[cyclohexyl(methyl)amino]ethyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 453.97 |
| Molecular Formula: | C25 H28 Cl N3 O3 |
| Smiles: | CN(CCNC(c1ccc2c(c1)NC(/C(=C/c1cccc(c1)[Cl])O2)=O)=O)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4722 |
| logD: | 3.5364 |
| logSw: | -4.7333 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.1 |
| InChI Key: | KCPLDUFWNNVCPD-UHFFFAOYSA-N |