9-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Chemical Structure Depiction of
9-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
9-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Compound characteristics
| Compound ID: | V004-9845 |
| Compound Name: | 9-[4-(2,3,5,6-tetramethylbenzene-1-sulfonyl)piperazin-1-yl]-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline |
| Molecular Weight: | 454.59 |
| Molecular Formula: | C23 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cc(C)c(C)c(c1C)S(N1CCN(CC1)C1=C2CCCCC2=Nc2ncnn12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1248 |
| logD: | 4.1247 |
| logSw: | -4.0678 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.149 |
| InChI Key: | OGQOJVKMFVLIIL-UHFFFAOYSA-N |