7-acetyl-1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3-(4-fluorophenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-acetyl-1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3-(4-fluorophenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
7-acetyl-1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3-(4-fluorophenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C728-0038 |
| Compound Name: | 7-acetyl-1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]-3-(4-fluorophenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 532.59 |
| Molecular Formula: | C28 H25 F N4 O4 S |
| Smiles: | CC(N1CCc2c3C(N(C(N(CC(N4CCCc5ccccc45)=O)c3sc2C1)=O)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0286 |
| logD: | 3.0286 |
| logSw: | -3.4734 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.214 |
| InChI Key: | YSERLESFUQSBBB-UHFFFAOYSA-N |