N-(5-chloro-2,4-dimethoxyphenyl)-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | M446-0109 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(3-oxo-8-phenoxy[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl)acetamide |
| Molecular Weight: | 455.86 |
| Molecular Formula: | C21 H18 Cl N5 O5 |
| Smiles: | COc1cc(c(cc1NC(CN1C(N2C=CN=C(C2=N1)Oc1ccccc1)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.4616 |
| logD: | 2.4593 |
| logSw: | -3.384 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.777 |
| InChI Key: | AKSGVPCKRIMPFI-UHFFFAOYSA-N |