(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[2-(pyridin-4-yl)ethyl]butanamide
Chemical Structure Depiction of
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[2-(pyridin-4-yl)ethyl]butanamide
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[2-(pyridin-4-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | Y043-6116 |
| Compound Name: | (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-4-(methylsulfanyl)-N-[2-(pyridin-4-yl)ethyl]butanamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C20 H22 N4 O3 S |
| Smiles: | CSCC[C@@H](C(NCCc1ccncc1)=O)N1C(c2ccccc2NC1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.633 |
| logD: | 1.5879 |
| logSw: | -2.3357 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.36 |
| InChI Key: | ZPZITIARSGWVPN-KRWDZBQOSA-N |