ethyl [3-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetate
Chemical Structure Depiction of
ethyl [3-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetate
ethyl [3-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetate
Compound characteristics
| Compound ID: | 8640-0170 |
| Compound Name: | ethyl [3-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl]acetate |
| Molecular Weight: | 448.92 |
| Molecular Formula: | C21 H21 Cl N2 O5 S |
| Smiles: | CCOC(CN1C(N(C(c2c3CC(C)(C)OCc3sc12)=O)c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9714 |
| logD: | 3.9714 |
| logSw: | -4.582 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.155 |
| InChI Key: | LYLFUYLSMBIMCG-UHFFFAOYSA-N |