rel-(5R,7S)-5-(4-iodophenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-5-(4-iodophenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-5-(4-iodophenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | G951-0077 |
| Compound Name: | rel-(5R,7S)-5-(4-iodophenyl)-7-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 445.3 |
| Molecular Formula: | C19 H20 I N5 |
| Smiles: | CC(C)c1ccc(cc1)[C@H]1C[C@@H](c2ccc(cc2)I)Nc2nnnn12 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.6139 |
| logD: | 5.6139 |
| logSw: | -5.7233 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.546 |
| InChI Key: | SRWWIBHQBSDFBO-QZTJIDSGSA-N |