2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(5-chloro-2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(5-chloro-2-methoxyphenyl)acetamide
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(5-chloro-2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | M460-1538 |
| Compound Name: | 2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(5-chloro-2-methoxyphenyl)acetamide |
| Molecular Weight: | 430.89 |
| Molecular Formula: | C20 H23 Cl N6 O3 |
| Smiles: | COc1ccc(cc1NC(CN1C(N2C=CN=C(C2=N1)N1CCCCCC1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4031 |
| logD: | 2.402 |
| logSw: | -3.3305 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.472 |
| InChI Key: | DWXSBPSSUIOOMS-UHFFFAOYSA-N |