N-(2-{1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl}ethyl)-3-(thiophen-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-(2-{1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl}ethyl)-3-(thiophen-2-yl)prop-2-enamide
N-(2-{1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl}ethyl)-3-(thiophen-2-yl)prop-2-enamide
Compound characteristics
Compound ID: | P073-0478 |
Compound Name: | N-(2-{1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-imidazo[4,5-b]pyridin-3-yl}ethyl)-3-(thiophen-2-yl)prop-2-enamide |
Molecular Weight: | 418.52 |
Molecular Formula: | C23 H22 N4 O2 S |
Smiles: | Cc1ccc(CN2C(N(CCNC(/C=C/c3cccs3)=O)c3c2cccn3)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.2446 |
logD: | 4.2445 |
logSw: | -4.057 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.489 |
InChI Key: | XQJYQAVWOAQMBD-UHFFFAOYSA-N |