N-(4-methoxyphenyl)-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-methoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
N-(4-methoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide
Compound characteristics
Compound ID: | L461-0361 |
Compound Name: | N-(4-methoxyphenyl)-4-oxo-4-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-1,4-diazepan-1-yl]butanamide |
Molecular Weight: | 439.54 |
Molecular Formula: | C22 H25 N5 O3 S |
Smiles: | COc1ccc(cc1)NC(CCC(N1CCCN(CC1)c1nc2cccnc2s1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4484 |
logD: | 2.4447 |
logSw: | -2.7705 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.585 |
InChI Key: | GBDOWJHJFRJRDQ-UHFFFAOYSA-N |