5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | 3909-8388 |
| Compound Name: | 5-methyl-3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-N-[4-({2-[2-(methylsulfanyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 707.83 |
| Molecular Formula: | C37 H33 N5 O6 S2 |
| Smiles: | CC1CCCN(C1)C(CN1C=Nc2c(C1=O)c(C)c(C(Nc1ccc(cc1)Oc1ccc3C(N(C(c3c1)=O)c1ccccc1SC)=O)=O)s2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2498 |
| logD: | 5.2486 |
| logSw: | -5.1774 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.747 |
| InChI Key: | XKWQAHIHHGPZCH-NRFANRHFSA-N |