1-(7-{3-methoxy-4-[(2-methylphenyl)methoxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Chemical Structure Depiction of
1-(7-{3-methoxy-4-[(2-methylphenyl)methoxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
1-(7-{3-methoxy-4-[(2-methylphenyl)methoxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one
Compound characteristics
| Compound ID: | 5976-1043 |
| Compound Name: | 1-(7-{3-methoxy-4-[(2-methylphenyl)methoxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethan-1-one |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C23 H24 N4 O3 |
| Smiles: | CC1=C(C(c2ccc(c(c2)OC)OCc2ccccc2C)n2c(N1)ncn2)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6026 |
| logD: | 3.5345 |
| logSw: | -3.6198 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.761 |
| InChI Key: | TYWBKDCWHKWBTG-QFIPXVFZSA-N |