3-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]propanamide
Chemical Structure Depiction of
3-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]propanamide
3-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]propanamide
Compound characteristics
| Compound ID: | Y043-6177 |
| Compound Name: | 3-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]propanamide |
| Molecular Weight: | 438.51 |
| Molecular Formula: | C21 H22 N6 O3 S |
| Smiles: | CSCC[C@@H](c1nnc2ccccn12)NC(CCN1C(c2ccccc2NC1=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6326 |
| logD: | 1.6316 |
| logSw: | -2.5143 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.171 |
| InChI Key: | MCJGUDVJSCOUHV-INIZCTEOSA-N |