N'-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
N'-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
Compound characteristics
Compound ID: | V022-1584 |
Compound Name: | N'-tert-butyl-N-(2-{4-[(2-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea |
Molecular Weight: | 471.62 |
Molecular Formula: | C25 H33 N3 O4 S |
Smiles: | CC(C)(C)NC(N(CC=C)CC(N1CCc2c(ccs2)C1COc1ccccc1OC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4421 |
logD: | 4.4421 |
logSw: | -4.1776 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.22 |
InChI Key: | NBXFOGCNGWUYTM-IBGZPJMESA-N |