3-(3-methoxyphenyl)-N,N,5-trimethyl-1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(3-methoxyphenyl)-N,N,5-trimethyl-1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(3-methoxyphenyl)-N,N,5-trimethyl-1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0114 |
| Compound Name: | 3-(3-methoxyphenyl)-N,N,5-trimethyl-1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 494.53 |
| Molecular Formula: | C24 H22 N4 O6 S |
| Smiles: | Cc1c2C(N(C(N(Cc3cccc(c3)[N+]([O-])=O)c2sc1C(N(C)C)=O)=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1732 |
| logD: | 3.1732 |
| logSw: | -3.4361 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.033 |
| InChI Key: | JHBWSHTVLJSLKV-UHFFFAOYSA-N |