1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0165 |
| Compound Name: | 1-[(2-cyanophenyl)methyl]-3-(4-ethylphenyl)-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 472.57 |
| Molecular Formula: | C26 H24 N4 O3 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c(C)c(C(N(C)C)=O)sc2N(Cc2ccccc2C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7431 |
| logD: | 3.7431 |
| logSw: | -4.053 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.164 |
| InChI Key: | JBNFYBHCZRSBTP-UHFFFAOYSA-N |