1-[2-(4-chlorophenyl)-2-oxoethyl]-3-cyclohexyl-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
1-[2-(4-chlorophenyl)-2-oxoethyl]-3-cyclohexyl-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
1-[2-(4-chlorophenyl)-2-oxoethyl]-3-cyclohexyl-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | 8640-0223 |
| Compound Name: | 1-[2-(4-chlorophenyl)-2-oxoethyl]-3-cyclohexyl-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 487.02 |
| Molecular Formula: | C25 H27 Cl N2 O4 S |
| Smiles: | CC1(C)Cc2c3C(N(C4CCCCC4)C(N(CC(c4ccc(cc4)[Cl])=O)c3sc2CO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5139 |
| logD: | 5.5139 |
| logSw: | -6.17 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.805 |
| InChI Key: | ZTDCGNNRQDFWSO-UHFFFAOYSA-N |