rel-(5R,7S)-5-(3-methoxyphenyl)-7-(2,3,4-trimethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
rel-(5R,7S)-5-(3-methoxyphenyl)-7-(2,3,4-trimethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
rel-(5R,7S)-5-(3-methoxyphenyl)-7-(2,3,4-trimethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-3639 |
| Compound Name: | rel-(5R,7S)-5-(3-methoxyphenyl)-7-(2,3,4-trimethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C20 H23 N5 O4 |
| Smiles: | COc1cccc(c1)[C@@H]1C[C@H](c2ccc(c(c2OC)OC)OC)n2c(N1)nnn2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9233 |
| logD: | 2.9233 |
| logSw: | -3.3543 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.154 |
| InChI Key: | AYHYWZFNIFXQEH-HOTGVXAUSA-N |