6-benzyl-7-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
6-benzyl-7-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
6-benzyl-7-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V011-2146 |
| Compound Name: | 6-benzyl-7-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 500.98 |
| Molecular Formula: | C23 H22 Cl F N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2)c(N2CCN(CC2)S(c2ccc(c(c2)[Cl])F)(=O)=O)n2c(ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1602 |
| logD: | 4.1246 |
| logSw: | -4.3733 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.822 |
| InChI Key: | SOUZUDZWIYQABE-UHFFFAOYSA-N |