3-(2-methoxyphenyl)-N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-(2-methoxyphenyl)-N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide--hydrogen chloride (1/1)
3-(2-methoxyphenyl)-N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0076 |
| Compound Name: | 3-(2-methoxyphenyl)-N-[7-(4-methoxyphenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]prop-2-enamide--hydrogen chloride (1/1) |
| Molecular Weight: | 516 |
| Molecular Formula: | C28 H25 N5 O3 |
| Salt: | HCl |
| Smiles: | COc1ccc(cc1)C1C=C(c2ccccc2)Nc2nc(NC(/C=C/c3ccccc3OC)=O)nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8137 |
| logD: | 5.8123 |
| logSw: | -5.7738 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.845 |
| InChI Key: | MWKRGPHMEROMEB-DTKKNGCVSA-N |