1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}azetidin-1-yl)-2-(2,5-dimethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}azetidin-1-yl)-2-(2,5-dimethoxyphenyl)ethan-1-one
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}azetidin-1-yl)-2-(2,5-dimethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | CM4697-2807 |
| Compound Name: | 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}azetidin-1-yl)-2-(2,5-dimethoxyphenyl)ethan-1-one |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C20 H26 N4 O3 |
| Smiles: | COc1ccc(c(CC(N2CC(Cc3nncn3CC3CC3)C2)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0701 |
| logD: | 2.0701 |
| logSw: | -2.6774 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.315 |
| InChI Key: | BAPRQFKJQJAHMD-UHFFFAOYSA-N |