N-[(4-methylphenyl)methyl]-2-[(2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[(2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
N-[(4-methylphenyl)methyl]-2-[(2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | K280-0444 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[(2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide |
| Molecular Weight: | 467.59 |
| Molecular Formula: | C27 H25 N5 O S |
| Smiles: | CCC(C(NCc1ccc(C)cc1)=O)Sc1nc2ccccc2c2nc(c3ccccc3)nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9209 |
| logD: | 5.9131 |
| logSw: | -5.741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.482 |
| InChI Key: | HLXSGHAIIFXLHS-QHCPKHFHSA-N |