N-(butan-2-yl)-N'-tert-butyl-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
Chemical Structure Depiction of
N-(butan-2-yl)-N'-tert-butyl-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
N-(butan-2-yl)-N'-tert-butyl-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea
Compound characteristics
| Compound ID: | V017-9921 |
| Compound Name: | N-(butan-2-yl)-N'-tert-butyl-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)urea |
| Molecular Weight: | 487.66 |
| Molecular Formula: | C26 H37 N3 O4 S |
| Smiles: | CCC(C)N(CC(N1CCc2c(ccs2)C1COc1cccc(c1)OC)=O)C(NC(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3213 |
| logD: | 5.3212 |
| logSw: | -5.272 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.397 |
| InChI Key: | VDELBAHJYSZUKK-UHFFFAOYSA-N |