3-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]butan-2-one
Chemical Structure Depiction of
3-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]butan-2-one
3-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]butan-2-one
Compound characteristics
Compound ID: | D306-0257 |
Compound Name: | 3-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]butan-2-one |
Molecular Weight: | 236.33 |
Molecular Formula: | C12 H16 N2 O S |
Smiles: | CC(C(C)=O)Sc1c2CCCc2nc(C)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.5399 |
logD: | 2.5393 |
logSw: | -2.2434 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 34.168 |
InChI Key: | SMHQUZUIJHWASL-QMMMGPOBSA-N |