6-(4-methoxyphenyl)-1,3-dimethyl-5-[2-oxo-1-(prop-2-yn-1-yl)-2,3-dihydro-1H-indol-3-yl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
6-(4-methoxyphenyl)-1,3-dimethyl-5-[2-oxo-1-(prop-2-yn-1-yl)-2,3-dihydro-1H-indol-3-yl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
6-(4-methoxyphenyl)-1,3-dimethyl-5-[2-oxo-1-(prop-2-yn-1-yl)-2,3-dihydro-1H-indol-3-yl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | D517-1061 |
| Compound Name: | 6-(4-methoxyphenyl)-1,3-dimethyl-5-[2-oxo-1-(prop-2-yn-1-yl)-2,3-dihydro-1H-indol-3-yl]-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C26 H22 N4 O4 |
| Smiles: | CN1C(c2c(C3C(N(CC#C)c4ccccc34)=O)c(c3ccc(cc3)OC)[nH]c2N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7176 |
| logD: | 3.037 |
| logSw: | -4.3515 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.748 |
| InChI Key: | JZZDCFUDHOLACT-IBGZPJMESA-N |