5-{[(3-chlorophenyl)methyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
5-{[(3-chlorophenyl)methyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
5-{[(3-chlorophenyl)methyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | K280-0170 |
| Compound Name: | 5-{[(3-chlorophenyl)methyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 402.9 |
| Molecular Formula: | C22 H15 Cl N4 S |
| Smiles: | C(c1cccc(c1)[Cl])Sc1nc2ccccc2c2nc(c3ccccc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 6.2886 |
| logD: | 6.2757 |
| logSw: | -6.6514 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7969 |
| InChI Key: | XTJFRJJTSLAYRB-UHFFFAOYSA-N |