rel-(5R,7S)-5-(3,4-dimethylphenyl)-7-(4-methylphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-5-(3,4-dimethylphenyl)-7-(4-methylphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-5-(3,4-dimethylphenyl)-7-(4-methylphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | G951-0123 |
| Compound Name: | rel-(5R,7S)-5-(3,4-dimethylphenyl)-7-(4-methylphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 319.41 |
| Molecular Formula: | C19 H21 N5 |
| Smiles: | Cc1ccc(cc1)[C@H]1C[C@@H](c2ccc(C)c(C)c2)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.4675 |
| logD: | 4.4675 |
| logSw: | -4.177 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.546 |
| InChI Key: | ILSSQILQWIOEHV-ROUUACIJSA-N |