N-(4-butylphenyl)-2-[3-(4-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(4-butylphenyl)-2-[3-(4-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-(4-butylphenyl)-2-[3-(4-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | C656-0635 |
| Compound Name: | N-(4-butylphenyl)-2-[3-(4-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C23 H24 N6 O3 |
| Smiles: | CCCCc1ccc(cc1)NC(CN1C=Nc2c(C1=O)nnn2c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8449 |
| logD: | 3.8449 |
| logSw: | -3.9933 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.851 |
| InChI Key: | PSMCIUNFDWBIML-UHFFFAOYSA-N |