2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanoic acid
Chemical Structure Depiction of
2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanoic acid
2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanoic acid
Compound characteristics
| Compound ID: | Y042-2968 |
| Compound Name: | 2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)butanoic acid |
| Molecular Weight: | 294.33 |
| Molecular Formula: | C13 H14 N2 O4 S |
| Smiles: | CSCCC(C(O)=O)N1C(c2ccccc2NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2992 |
| logD: | -2.4603 |
| logSw: | -2.3075 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.085 |
| InChI Key: | RPNUTXCHADQPNY-JTQLQIEISA-N |