1-(4-phenylpiperazin-1-yl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propan-1-one
Chemical Structure Depiction of
1-(4-phenylpiperazin-1-yl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propan-1-one
1-(4-phenylpiperazin-1-yl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propan-1-one
Compound characteristics
| Compound ID: | J084-0287 |
| Compound Name: | 1-(4-phenylpiperazin-1-yl)-2-[(5-phenyl[1,2,4]triazolo[4,3-c]quinazolin-3-yl)sulfanyl]propan-1-one |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C28 H26 N6 O S |
| Smiles: | CC(C(N1CCN(CC1)c1ccccc1)=O)Sc1nnc2c3ccccc3nc(c3ccccc3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1697 |
| logD: | 5.1619 |
| logSw: | -5.2331 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.49 |
| InChI Key: | IVIVSAZMPJNEBU-FQEVSTJZSA-N |