2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C311-0213 |
| Compound Name: | 2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[(1-ethylpyrrolidin-2-yl)methyl]acetamide |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C24 H26 Cl N3 O3 |
| Smiles: | [H]N(CC1CCCN1CC)C(CN1C(/C(=C\c2cccc(c2)[Cl])Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4373 |
| logD: | 2.454 |
| logSw: | -3.9506 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.411 |
| InChI Key: | LCOOPOKSONDHFX-LJQANCHMSA-N |