2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C311-1216 |
| Compound Name: | 2-{2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 454.93 |
| Molecular Formula: | C25 H24 Cl F N2 O3 |
| Smiles: | C1CCC(CCNC(CN2C(/C(=C/c3c(cccc3[Cl])F)Oc3ccccc23)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4882 |
| logD: | 4.4882 |
| logSw: | -4.611 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.538 |
| InChI Key: | AXPMBJVOAMYVQU-UHFFFAOYSA-N |