2-[2-(3,4-dimethoxyphenyl)ethenyl]-5H-[1,2,4]triazolo[1,5-d][1,4]benzodiazepin-6(7H)-one
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)ethenyl]-5H-[1,2,4]triazolo[1,5-d][1,4]benzodiazepin-6(7H)-one
2-[2-(3,4-dimethoxyphenyl)ethenyl]-5H-[1,2,4]triazolo[1,5-d][1,4]benzodiazepin-6(7H)-one
Compound characteristics
| Compound ID: | 8019-4941 |
| Compound Name: | 2-[2-(3,4-dimethoxyphenyl)ethenyl]-5H-[1,2,4]triazolo[1,5-d][1,4]benzodiazepin-6(7H)-one |
| Molecular Weight: | 362.39 |
| Molecular Formula: | C20 H18 N4 O3 |
| Smiles: | COc1ccc(/C=C/c2nc3c4ccccc4NC(Cn3n2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5527 |
| logD: | 2.5527 |
| logSw: | -3.2519 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.416 |
| InChI Key: | FWMRCQVGYCEVAP-UHFFFAOYSA-N |