N'-ethyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
Chemical Structure Depiction of
N'-ethyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
N'-ethyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
Compound characteristics
| Compound ID: | V021-9903 |
| Compound Name: | N'-ethyl-N-(2-methylbutyl)-N-(2-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea |
| Molecular Weight: | 457.63 |
| Molecular Formula: | C25 H35 N3 O3 S |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1)=O)C(NCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2055 |
| logD: | 5.2055 |
| logSw: | -4.9389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.326 |
| InChI Key: | CHHCAQPOPAXWST-UHFFFAOYSA-N |