benzyl {3-[3-(benzylamino)-3-oxopropyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
Chemical Structure Depiction of
benzyl {3-[3-(benzylamino)-3-oxopropyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
benzyl {3-[3-(benzylamino)-3-oxopropyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
Compound characteristics
| Compound ID: | C241-1275 |
| Compound Name: | benzyl {3-[3-(benzylamino)-3-oxopropyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C25 H23 N3 O5 S |
| Smiles: | C(CN1C(c2c(ccs2)N(CC(=O)OCc2ccccc2)C1=O)=O)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5115 |
| logD: | 3.5115 |
| logSw: | -3.6371 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.269 |
| InChI Key: | CTXCHCPDSCTKBS-UHFFFAOYSA-N |