2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(3-methylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(3-methylpiperidin-1-yl)ethan-1-one
2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(3-methylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D692-0596 |
| Compound Name: | 2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(3-methylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C21 H21 N5 O2 S |
| Smiles: | CC1CCCN(C1)C(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4393 |
| logD: | 3.4393 |
| logSw: | -3.6857 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.215 |
| InChI Key: | GJDVIODXTLVIRK-AWEZNQCLSA-N |