3-{3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}-1-(4-hydroxyphenyl)prop-2-en-1-one
Chemical Structure Depiction of
3-{3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}-1-(4-hydroxyphenyl)prop-2-en-1-one
3-{3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}-1-(4-hydroxyphenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y505-4566 |
| Compound Name: | 3-{3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}-1-(4-hydroxyphenyl)prop-2-en-1-one |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C23 H19 N3 O3 |
| Smiles: | COc1ccc(/C=C/C(c2ccc(cc2)O)=O)cc1Cn1c2ccccc2nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.6782 |
| logD: | 3.3713 |
| logSw: | -4.1149 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.887 |
| InChI Key: | ABOVCHMGGVPUAX-UHFFFAOYSA-N |