N-(4-ethoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
N-(4-ethoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
Compound characteristics
Compound ID: | L461-0394 |
Compound Name: | N-(4-ethoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide |
Molecular Weight: | 453.56 |
Molecular Formula: | C23 H27 N5 O3 S |
Smiles: | CCOc1ccc(cc1)NC(CCC(N1CCCN(CC1)c1nc2cccnc2s1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.835 |
logD: | 2.8313 |
logSw: | -3.3511 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.165 |
InChI Key: | LFCNMXBJSSXTBL-UHFFFAOYSA-N |