rel-(5R,7S)-7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | G951-0191 |
| Compound Name: | rel-(5R,7S)-7-(3-bromophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 434.72 |
| Molecular Formula: | C18 H17 Br Cl N5 O |
| Smiles: | CCOc1ccc(cc1[Cl])[C@@H]1C[C@H](c2cccc(c2)[Br])n2c(N1)nnn2 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.6489 |
| logD: | 4.6489 |
| logSw: | -5.02 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.756 |
| InChI Key: | ANZATPZEYWOANC-HOTGVXAUSA-N |