2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-ethylphenyl)acetamide
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | C241-1930 |
| Compound Name: | 2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 552.65 |
| Molecular Formula: | C31 H28 N4 O4 S |
| Smiles: | CCc1cccc(c1)NC(CN1C(N(C(c2c1ccs2)=O)c1ccc(CC(NCc2ccccc2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4889 |
| logD: | 4.4889 |
| logSw: | -4.3106 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.023 |
| InChI Key: | MFCBOCBOJYREHC-UHFFFAOYSA-N |