ethyl {7-[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetate
Chemical Structure Depiction of
ethyl {7-[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetate
ethyl {7-[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetate
Compound characteristics
| Compound ID: | V015-5401 |
| Compound Name: | ethyl {7-[4-(3,5-dichlorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}acetate |
| Molecular Weight: | 513.4 |
| Molecular Formula: | C20 H22 Cl2 N6 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(Cc1c(C)nc2ncnn2c1N1CCN(CC1)S(c1cc(cc(c1)[Cl])[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2442 |
| logD: | 3.1569 |
| logSw: | -3.5427 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.253 |
| InChI Key: | BQHNIODNDRHSLA-UHFFFAOYSA-N |