1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0256 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-N,N-diethyl-5-methyl-2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 528.04 |
| Molecular Formula: | C27 H27 Cl F N3 O3 S |
| Smiles: | CCN(CC)C(c1c(C)c2C(N(CCc3ccccc3)C(N(Cc3ccc(cc3[Cl])F)c2s1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7806 |
| logD: | 5.7806 |
| logSw: | -6.1116 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.629 |
| InChI Key: | CNJPDDHDTRYCTM-UHFFFAOYSA-N |