2-{[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]methylidene}-6,7,8,9-tetrahydro-5H-[1]benzothieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-1,5(2H)-dione
Chemical Structure Depiction of
2-{[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]methylidene}-6,7,8,9-tetrahydro-5H-[1]benzothieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-1,5(2H)-dione
2-{[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]methylidene}-6,7,8,9-tetrahydro-5H-[1]benzothieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-1,5(2H)-dione
Compound characteristics
| Compound ID: | 8012-5421 |
| Compound Name: | 2-{[5-(4-chloro-2,5-dimethoxyphenyl)furan-2-yl]methylidene}-6,7,8,9-tetrahydro-5H-[1]benzothieno[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-1,5(2H)-dione |
| Molecular Weight: | 527.02 |
| Molecular Formula: | C25 H19 Cl N2 O5 S2 |
| Smiles: | COc1cc(c(cc1c1ccc(\C=C2/C(N3C(=NC(c4c5CCCCc5sc34)=O)S2)=O)o1)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8852 |
| logD: | 5.8852 |
| logSw: | -6.2117 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.757 |
| InChI Key: | MKKUJKIDFKINDD-UHFFFAOYSA-N |