3-(4-methylphenyl)-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-methylphenyl)-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-(4-methylphenyl)-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C200-0835 |
| Compound Name: | 3-(4-methylphenyl)-1-[2-(3-nitrophenyl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C21 H15 N3 O5 S |
| Smiles: | Cc1ccc(cc1)N1C(c2c(ccs2)N(CC(c2cccc(c2)[N+]([O-])=O)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8642 |
| logD: | 3.8642 |
| logSw: | -4.0034 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.302 |
| InChI Key: | GNLUHWCOYPMDCH-UHFFFAOYSA-N |