{4-[8-chloro-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(4-methylphenyl)methanone
Chemical Structure Depiction of
{4-[8-chloro-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(4-methylphenyl)methanone
{4-[8-chloro-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(4-methylphenyl)methanone
Compound characteristics
| Compound ID: | V019-6000 |
| Compound Name: | {4-[8-chloro-3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(4-methylphenyl)methanone |
| Molecular Weight: | 489 |
| Molecular Formula: | C25 H21 Cl N6 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3cccs3)n12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3569 |
| logD: | 5.3156 |
| logSw: | -6.067 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.468 |
| InChI Key: | VNTLGPGXVMZWOZ-UHFFFAOYSA-N |