2-{[4-amino-5-(benzenesulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)butanamide
Chemical Structure Depiction of
2-{[4-amino-5-(benzenesulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)butanamide
2-{[4-amino-5-(benzenesulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)butanamide
Compound characteristics
Compound ID: | E682-0048 |
Compound Name: | 2-{[4-amino-5-(benzenesulfonyl)pyrimidin-2-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)butanamide |
Molecular Weight: | 472.58 |
Molecular Formula: | C22 H24 N4 O4 S2 |
Smiles: | CCC(C(Nc1cc(C)ccc1OC)=O)Sc1ncc(c(N)n1)S(c1ccccc1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6026 |
logD: | 3.6026 |
logSw: | -3.7688 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 98.275 |
InChI Key: | DTVBUPXPNCEFPA-SFHVURJKSA-N |