N-(3-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)butanamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)butanamide
N-(3-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)butanamide
Compound characteristics
| Compound ID: | D579-0121 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)butanamide |
| Molecular Weight: | 382.85 |
| Molecular Formula: | C20 H19 Cl N4 O2 |
| Smiles: | CCC(C(Nc1cccc(c1C)[Cl])=O)N1C(N=C(C=N1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6158 |
| logD: | 4.6141 |
| logSw: | -4.6607 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.844 |
| InChI Key: | DTCLDDLDCBUWLG-SFHVURJKSA-N |