N'-tert-butyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylpropyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylpropyl)urea
N'-tert-butyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylpropyl)urea
Compound characteristics
| Compound ID: | V002-3103 |
| Compound Name: | N'-tert-butyl-N-(2-{4-[(2-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylpropyl)urea |
| Molecular Weight: | 471.66 |
| Molecular Formula: | C26 H37 N3 O3 S |
| Smiles: | CC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccccc1C)=O)C(NC(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8587 |
| logD: | 5.8587 |
| logSw: | -5.5441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.611 |
| InChI Key: | ZJQRXEQTCBEXKP-NRFANRHFSA-N |