1-[(2,5-dimethylphenyl)methyl]-N,N,5-trimethyl-3-(2-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-N,N,5-trimethyl-3-(2-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
1-[(2,5-dimethylphenyl)methyl]-N,N,5-trimethyl-3-(2-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0431 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-N,N,5-trimethyl-3-(2-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(C(c3c(C)c(C(N(C)C)=O)sc23)=O)c2ccccc2[N+]([O-])=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.239 |
| logD: | 4.239 |
| logSw: | -4.4925 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.887 |
| InChI Key: | DARBLMUIMRKSGB-UHFFFAOYSA-N |