N-(4-bromophenyl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
N-(4-bromophenyl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | C561-1808 |
| Compound Name: | N-(4-bromophenyl)-3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 510.39 |
| Molecular Formula: | C24 H24 Br N5 O3 |
| Smiles: | Cc1c(CCC(Nc2ccc(cc2)[Br])=O)c(C)n2c(n1)nc(c1cc(cc(c1)OC)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.557 |
| logD: | 4.4256 |
| logSw: | -4.4492 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.07 |
| InChI Key: | XBBKSURIHHCCBA-UHFFFAOYSA-N |