5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C186-0453 |
| Compound Name: | 5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 509.69 |
| Molecular Formula: | C23 H35 N5 O4 S2 |
| Smiles: | CCCN1CCN(CC1)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CC(C)CC(C)C1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7375 |
| logD: | 1.555 |
| logSw: | -1.9669 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.002 |
| InChI Key: | CHFDLFJKPMQXBT-UHFFFAOYSA-N |