3-(3,4-dimethylphenyl)-5,6-dimethyl-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-5,6-dimethyl-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-(3,4-dimethylphenyl)-5,6-dimethyl-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C200-0628 |
| Compound Name: | 3-(3,4-dimethylphenyl)-5,6-dimethyl-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C24 H21 N3 O5 S |
| Smiles: | Cc1ccc(cc1C)N1C(c2c(C)c(C)sc2N(CC(c2cccc(c2)[N+]([O-])=O)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2621 |
| logD: | 5.2621 |
| logSw: | -5.2477 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.735 |
| InChI Key: | QIEBGLHGJHAPGO-UHFFFAOYSA-N |