(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-methyl-1H-pyrazol-5-yl)-4-(methylsulfanyl)butanamide
Chemical Structure Depiction of
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-methyl-1H-pyrazol-5-yl)-4-(methylsulfanyl)butanamide
(2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-methyl-1H-pyrazol-5-yl)-4-(methylsulfanyl)butanamide
Compound characteristics
Compound ID: | Y044-5106 |
Compound Name: | (2S)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-(3-methyl-1H-pyrazol-5-yl)-4-(methylsulfanyl)butanamide |
Molecular Weight: | 373.43 |
Molecular Formula: | C17 H19 N5 O3 S |
Smiles: | Cc1cc(NC([C@H](CCSC)N2C(c3ccccc3NC2=O)=O)=O)[nH]n1 |
Stereo: | ABSOLUTE |
logP: | 1.8184 |
logD: | 1.8177 |
logSw: | -2.7507 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.903 |
InChI Key: | YAVPCTVFVSCBBC-ZDUSSCGKSA-N |