methyl 4-hydroxy-5-[6-(3-methoxyphenyl)-1-methyl-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-(3-methoxyphenyl)-1-methyl-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-(3-methoxyphenyl)-1-methyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | D343-0479 |
| Compound Name: | methyl 4-hydroxy-5-[6-(3-methoxyphenyl)-1-methyl-2,4-dioxo-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methylthiophene-3-carboxylate |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C21 H19 N3 O6 S |
| Smiles: | Cc1c(C(=O)OC)c(c(c2c3C(NC(N(C)c3[nH]c2c2cccc(c2)OC)=O)=O)s1)O |
| Stereo: | ACHIRAL |
| logP: | 3.5088 |
| logD: | 2.7438 |
| logSw: | -4.0447 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.615 |
| InChI Key: | USYKGEFTPABVKZ-UHFFFAOYSA-N |