5-(3,4-dimethylphenyl)-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(3,4-dimethylphenyl)-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
5-(3,4-dimethylphenyl)-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-4489 |
| Compound Name: | 5-(3,4-dimethylphenyl)-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | Cc1ccc(cc1C)C1=CC(c2cccc(c2)[N+]([O-])=O)n2c(N1)ncn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4993 |
| logD: | 4.4947 |
| logSw: | -4.3819 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.981 |
| InChI Key: | MGOBIWYEAMRIER-SFHVURJKSA-N |