N-{4-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-{4-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide
N-{4-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | V006-0433 |
| Compound Name: | N-{4-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 529.6 |
| Molecular Formula: | C32 H27 N5 O3 |
| Salt: | not_available |
| Smiles: | CCCc1c(cnn1c1ccccc1)C(Nc1ccc(cc1)c1cccc(c2ccc3c(c2)NC(CO3)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2678 |
| logD: | 6.2654 |
| logSw: | -5.4198 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.248 |
| InChI Key: | AVPHGJOKHLWSQR-UHFFFAOYSA-N |