(5-chlorothiophen-2-yl)[4-(3-methyl-5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(5-chlorothiophen-2-yl)[4-(3-methyl-5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]methanone
(5-chlorothiophen-2-yl)[4-(3-methyl-5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | P664-1973 |
| Compound Name: | (5-chlorothiophen-2-yl)[4-(3-methyl-5-propyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 404.92 |
| Molecular Formula: | C18 H21 Cl N6 O S |
| Smiles: | CCCc1cc(nc2nnc(C)n12)N1CCN(CC1)C(c1ccc(s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.48 |
| logD: | 3.4799 |
| logSw: | -3.7722 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.214 |
| InChI Key: | HMDMKLLKOWJLTN-UHFFFAOYSA-N |