2-[2-(cyclohex-1-en-1-yl)ethyl]-8-(3-methyl-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-(cyclohex-1-en-1-yl)ethyl]-8-(3-methyl-1H-1,2,4-triazol-5-yl)pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
2-[2-(cyclohex-1-en-1-yl)ethyl]-8-(3-methyl-1H-1,2,4-triazol-5-yl)pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
Compound characteristics
| Compound ID: | Y020-3696 |
| Compound Name: | 2-[2-(cyclohex-1-en-1-yl)ethyl]-8-(3-methyl-1H-1,2,4-triazol-5-yl)pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C22 H22 N6 O2 |
| Smiles: | Cc1nc([nH]n1)N1C=Cc2c(cc3C(N(CCC4CCCCC=4)C=Cc3n2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.696 |
| logD: | 2.6928 |
| logSw: | -3.0501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.062 |
| InChI Key: | XUHQQELOWJSOSF-UHFFFAOYSA-N |