{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | V004-4209 |
| Compound Name: | {4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 474.97 |
| Molecular Formula: | C24 H19 Cl N6 O S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1cccs1)=O)c1nc2ccccc2c2nnc(c3ccc(cc3)[Cl])n12 |
| Stereo: | ACHIRAL |
| logP: | 5.0387 |
| logD: | 4.9776 |
| logSw: | -5.4147 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.468 |
| InChI Key: | NVYHUYWUFGZVPI-UHFFFAOYSA-N |