methyl [3-(4-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
methyl [3-(4-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
methyl [3-(4-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: | 8640-0173 |
| Compound Name: | methyl [3-(4-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: | 434.9 |
| Molecular Formula: | C20 H19 Cl N2 O5 S |
| Smiles: | CC1(C)Cc2c3C(N(C(N(CC(=O)OC)c3sc2CO1)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3919 |
| logD: | 3.3919 |
| logSw: | -4.3353 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.575 |
| InChI Key: | BBRGJGSFIBRWKU-UHFFFAOYSA-N |