4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-(3-ethylphenyl)benzamide
Chemical Structure Depiction of
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-(3-ethylphenyl)benzamide
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-(3-ethylphenyl)benzamide
Compound characteristics
| Compound ID: | C203-0072 |
| Compound Name: | 4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-(3-ethylphenyl)benzamide |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C22 H19 N3 O3 S |
| Smiles: | CCc1cccc(c1)NC(c1ccc(CN2C(c3c(ccs3)NC2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3475 |
| logD: | 4.3473 |
| logSw: | -4.3034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.59 |
| InChI Key: | QRJDWTDZHJTIFG-UHFFFAOYSA-N |