7-(3,4-dichlorophenyl)-2-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(3,4-dichlorophenyl)-2-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
7-(3,4-dichlorophenyl)-2-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V008-3820 |
| Compound Name: | 7-(3,4-dichlorophenyl)-2-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 559.52 |
| Molecular Formula: | C26 H28 Cl2 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c(C)c(C)c(c(C)c1C)S(N1CCN(CC1)c1nc2nccc(c3ccc(c(c3)[Cl])[Cl])n2n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6092 |
| logD: | 6.6091 |
| logSw: | -6.522 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.111 |
| InChI Key: | NEPOODCQXAVNMA-UHFFFAOYSA-N |