methyl 4-hydroxy-5-[6-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4-hydroxy-5-[6-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate
methyl 4-hydroxy-5-[6-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | D343-0065 |
| Compound Name: | methyl 4-hydroxy-5-[6-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate |
| Molecular Weight: | 455.49 |
| Molecular Formula: | C22 H21 N3 O6 S |
| Smiles: | Cc1c(C(=O)OC)c(c(c2c3C(N(C)C(N(C)c3[nH]c2c2ccc(cc2)OC)=O)=O)s1)O |
| Stereo: | ACHIRAL |
| logP: | 3.7748 |
| logD: | 3.0098 |
| logSw: | -4.2751 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.701 |
| InChI Key: | SUCCTODRYSQQOF-UHFFFAOYSA-N |