2-(2,5-dimethylphenyl)-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
Chemical Structure Depiction of
2-(2,5-dimethylphenyl)-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
2-(2,5-dimethylphenyl)-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
Compound characteristics
| Compound ID: | Y020-4188 |
| Compound Name: | 2-(2,5-dimethylphenyl)-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione |
| Molecular Weight: | 430.49 |
| Molecular Formula: | C22 H18 N6 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1C=Cc2c(cc3C(N(C=Cc3n2)c2nc(n[nH]2)SC)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.9684 |
| logD: | 3.9519 |
| logSw: | -4.1064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.254 |
| InChI Key: | ZBROIKCPGPFNFI-UHFFFAOYSA-N |