2-{3-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{3-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propyl}-1H-isoindole-1,3(2H)-dione
2-{3-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | D308-0181 |
| Compound Name: | 2-{3-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 430.53 |
| Molecular Formula: | C24 H22 N4 O2 S |
| Smiles: | Cc1cc(C)c2c(c1)c(C)cc1nnc(n12)SCCCN1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.168 |
| logD: | 5.1679 |
| logSw: | -4.8869 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.361 |
| InChI Key: | GCRZXQIJMMTALF-UHFFFAOYSA-N |