N-[(furan-2-yl)methyl]-4-({1-[2-(3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-({1-[2-(3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
N-[(furan-2-yl)methyl]-4-({1-[2-(3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | C241-1961 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-({1-[2-(3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)benzamide |
| Molecular Weight: | 528.59 |
| Molecular Formula: | C28 H24 N4 O5 S |
| Smiles: | Cc1cccc(c1)NC(CN1C(N(Cc2ccc(cc2)C(NCc2ccco2)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6261 |
| logD: | 4.626 |
| logSw: | -4.3069 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.597 |
| InChI Key: | ATGYFUVZCXWZNJ-UHFFFAOYSA-N |