N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Compound characteristics
| Compound ID: | C060-0038 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | Cc1c2C(N(CC(NCCCC(Nc3ccc4c(c3)OCCO4)=O)=O)C=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4868 |
| logD: | 0.4868 |
| logSw: | -2.3469 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.527 |
| InChI Key: | YUTMEMXPMJAVHB-UHFFFAOYSA-N |