1-{4-[2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propoxy]-3-methoxyphenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propoxy]-3-methoxyphenyl}ethan-1-one
1-{4-[2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propoxy]-3-methoxyphenyl}ethan-1-one
Compound characteristics
| Compound ID: | 8017-4500 |
| Compound Name: | 1-{4-[2-hydroxy-3-(1H-1,2,4-triazol-1-yl)propoxy]-3-methoxyphenyl}ethan-1-one |
| Molecular Weight: | 291.3 |
| Molecular Formula: | C14 H17 N3 O4 |
| Smiles: | CC(c1ccc(c(c1)OC)OCC(Cn1cncn1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1509 |
| logD: | 0.1509 |
| logSw: | -1.4028 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.878 |
| InChI Key: | IHWQZCCPAFDDMU-LBPRGKRZSA-N |