3-[2-(azepan-1-yl)-2-oxoethyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
3-[2-(azepan-1-yl)-2-oxoethyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | K802-0448 |
Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one |
Molecular Weight: | 367.47 |
Molecular Formula: | C20 H21 N3 O2 S |
Smiles: | C1CCCN(CC1)C(CN1C=Nc2c(C1=O)c(cs2)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 2.9601 |
logD: | 2.9601 |
logSw: | -3.2687 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.693 |
InChI Key: | KLZRSZJBAKRXPF-UHFFFAOYSA-N |