3-benzyl-1-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
3-benzyl-1-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
3-benzyl-1-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C258-0449 |
| Compound Name: | 3-benzyl-1-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C25 H29 N3 O3 S |
| Smiles: | CC1CC(C)CN(C1)C(CN1C(N(Cc2ccccc2)C(c2c3CCCc3sc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5961 |
| logD: | 4.5961 |
| logSw: | -4.5188 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.264 |
| InChI Key: | TWYOEOREYMHUJT-UHFFFAOYSA-N |