N'-tert-butyl-N-(3-methylbutyl)-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-(3-methylbutyl)-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}urea
N'-tert-butyl-N-(3-methylbutyl)-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}urea
Compound characteristics
| Compound ID: | V022-0628 |
| Compound Name: | N'-tert-butyl-N-(3-methylbutyl)-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}urea |
| Molecular Weight: | 513.74 |
| Molecular Formula: | C29 H43 N3 O3 S |
| Smiles: | CC(C)CCN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)C(C)C)=O)C(NC(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9753 |
| logD: | 6.9753 |
| logSw: | -5.7015 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.503 |
| InChI Key: | VBKDNWCDZKFURO-VWLOTQADSA-N |