9-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Chemical Structure Depiction of
9-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
9-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Compound characteristics
| Compound ID: | V009-0281 |
| Compound Name: | 9-{4-[2-(trifluoromethoxy)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline |
| Molecular Weight: | 482.48 |
| Molecular Formula: | C20 H21 F3 N6 O3 S |
| Salt: | not_available |
| Smiles: | C1CCC2C(C1)=C(N1CCN(CC1)S(c1ccccc1OC(F)(F)F)(=O)=O)n1c(N=2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 3.5523 |
| logD: | 3.5523 |
| logSw: | -3.7845 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.172 |
| InChI Key: | BKAILLSLZFMLHI-UHFFFAOYSA-N |