N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-7-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-7-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-7-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-1789 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[3-oxo-7-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 402.84 |
| Molecular Formula: | C18 H19 Cl N6 O3 |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N2C=CC(=NC2=N1)N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1176 |
| logD: | 2.1175 |
| logSw: | -3.1607 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.202 |
| InChI Key: | SEBVVXUNLOVJNQ-UHFFFAOYSA-N |