9-{4-[4-(2-methylbutan-2-yl)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-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
9-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline
Compound characteristics
| Compound ID: | V001-9773 |
| Compound Name: | 9-{4-[4-(2-methylbutan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazoline |
| Molecular Weight: | 468.62 |
| Molecular Formula: | C24 H32 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)(C)c1ccc(cc1)S(N1CCN(CC1)C1=C2CCCCC2=Nc2ncnn12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4699 |
| logD: | 4.4698 |
| logSw: | -4.1677 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.149 |
| InChI Key: | NVCZVDXWPVZKNJ-UHFFFAOYSA-N |