2-phenyl-1-{4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
2-phenyl-1-{4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}butan-1-one
2-phenyl-1-{4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V025-0338 |
| Compound Name: | 2-phenyl-1-{4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 482.61 |
| Molecular Formula: | C27 H26 N6 O S |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3cccs3)n12)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2058 |
| logD: | 5.1672 |
| logSw: | -5.3219 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.468 |
| InChI Key: | MTNDMAAYINXIRK-HXUWFJFHSA-N |