2-phenyl-1-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]butan-1-one
Chemical Structure Depiction of
2-phenyl-1-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]butan-1-one
2-phenyl-1-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]butan-1-one
Compound characteristics
| Compound ID: | V021-6107 |
| Compound Name: | 2-phenyl-1-[4-(3-phenyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl]butan-1-one |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C30 H30 N6 O |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCCN(CC1)c1nc2ccccc2c2nnc(c3ccccc3)n12)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6487 |
| logD: | 5.5875 |
| logSw: | -5.7955 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.78 |
| InChI Key: | XULPOFMXXQCJLA-XMMPIXPASA-N |