4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-(3,4,5-trimethoxyphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-(3,4,5-trimethoxyphenyl)-1,4-diazepane-1-carboxamide
4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-(3,4,5-trimethoxyphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V002-8544 |
| Compound Name: | 4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-(3,4,5-trimethoxyphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 533.59 |
| Molecular Formula: | C27 H31 N7 O5 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1cnc2ncnn2c1N1CCCN(CC1)C(Nc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9055 |
| logD: | 2.8959 |
| logSw: | -3.4571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.378 |
| InChI Key: | HZGSMEIUFJRXBT-UHFFFAOYSA-N |