2-({3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-3,4-dihydronaphthalen-1(2H)-one
Chemical Structure Depiction of
2-({3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-3,4-dihydronaphthalen-1(2H)-one
2-({3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-3,4-dihydronaphthalen-1(2H)-one
Compound characteristics
| Compound ID: | 4333-5820 |
| Compound Name: | 2-({3-[(1H-benzotriazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-3,4-dihydronaphthalen-1(2H)-one |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C25 H21 N3 O2 |
| Smiles: | COc1ccc(\C=C2/CCc3ccccc3C2=O)cc1Cn1c2ccccc2nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7388 |
| logD: | 4.7388 |
| logSw: | -4.5942 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.09 |
| InChI Key: | ORKDDNHAHLVDKG-UHFFFAOYSA-N |