ethyl 1-butyl-3-(4-fluorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Chemical Structure Depiction of
ethyl 1-butyl-3-(4-fluorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
ethyl 1-butyl-3-(4-fluorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Compound characteristics
| Compound ID: | C694-0227 |
| Compound Name: | ethyl 1-butyl-3-(4-fluorophenyl)-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate |
| Molecular Weight: | 445.51 |
| Molecular Formula: | C22 H24 F N3 O4 S |
| Smiles: | CCCCN1C(N(C(c2c3CCN(Cc3sc12)C(=O)OCC)=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.161 |
| logD: | 4.161 |
| logSw: | -4.1034 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.991 |
| InChI Key: | VFWLFJZJQGJVFT-UHFFFAOYSA-N |