2-(6-{[3-methyl-4-(propan-2-yl)phenoxy]acetyl}-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-(6-{[3-methyl-4-(propan-2-yl)phenoxy]acetyl}-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(pyridin-3-yl)methyl]acetamide
2-(6-{[3-methyl-4-(propan-2-yl)phenoxy]acetyl}-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | V017-6839 |
| Compound Name: | 2-(6-{[3-methyl-4-(propan-2-yl)phenoxy]acetyl}-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[(pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C28 H29 N3 O5 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1C)OCC(c1ccc2c(c1)N(CC(NCc1cccnc1)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2949 |
| logD: | 3.2925 |
| logSw: | -3.25 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.532 |
| InChI Key: | QBXIFUQZTMUSBB-UHFFFAOYSA-N |