ethyl ({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | 8017-0252 |
| Compound Name: | ethyl ({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CCOC(CSc1nnc(CN2c3ccccc3C(c3ccccc23)=O)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6429 |
| logD: | 2.6428 |
| logSw: | -3.3556 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.922 |
| InChI Key: | REUDDUZJERGIDN-UHFFFAOYSA-N |