1-ethyl-3-methyl-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6-[(thiophen-2-yl)methyl]-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
1-ethyl-3-methyl-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6-[(thiophen-2-yl)methyl]-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
1-ethyl-3-methyl-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6-[(thiophen-2-yl)methyl]-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C200-5977 |
| Compound Name: | 1-ethyl-3-methyl-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-6-[(thiophen-2-yl)methyl]-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 445.6 |
| Molecular Formula: | C21 H27 N5 O2 S2 |
| Smiles: | CCn1c2C(N(Cc3cccs3)C(=Nc2c(C)n1)SCC(N1CCCCC1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4992 |
| logD: | 2.4992 |
| logSw: | -2.4284 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.134 |
| InChI Key: | IQLBQYRVLHPULC-AWEZNQCLSA-N |