rel-(5R,7S)-5-[4-(propan-2-yl)phenyl]-7-(thiophen-2-yl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-5-[4-(propan-2-yl)phenyl]-7-(thiophen-2-yl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-5-[4-(propan-2-yl)phenyl]-7-(thiophen-2-yl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | G951-0259 |
| Compound Name: | rel-(5R,7S)-5-[4-(propan-2-yl)phenyl]-7-(thiophen-2-yl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 325.43 |
| Molecular Formula: | C17 H19 N5 S |
| Smiles: | CC(C)c1ccc(cc1)[C@@H]1C[C@H](c2cccs2)n2c(N1)nnn2 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.0504 |
| logD: | 4.0504 |
| logSw: | -4.0466 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.564 |
| InChI Key: | UMPMSJPVEWZXBF-HUUCEWRRSA-N |