N-(4-chlorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
N-(4-chlorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
Compound characteristics
| Compound ID: | K280-0379 |
| Compound Name: | N-(4-chlorophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide |
| Molecular Weight: | 520.06 |
| Molecular Formula: | C26 H26 Cl N7 O S |
| Smiles: | CCC(C(Nc1ccc(cc1)[Cl])=O)Sc1nc2ccccc2c2nc(CCn3c(C)cc(C)n3)nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9202 |
| logD: | 4.7783 |
| logSw: | -4.8474 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.136 |
| InChI Key: | YWXRGLMXBSKTQY-QFIPXVFZSA-N |