7-(4-tert-butylphenyl)-2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(4-tert-butylphenyl)-2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
7-(4-tert-butylphenyl)-2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V002-8036 |
| Compound Name: | 7-(4-tert-butylphenyl)-2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 529.04 |
| Molecular Formula: | C25 H26 Cl F N6 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)c1ccnc2nc(nn12)N1CCN(CC1)S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.666 |
| logD: | 5.6659 |
| logSw: | -6.0468 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.111 |
| InChI Key: | HRWJLQJQDLZLGC-UHFFFAOYSA-N |