N-(2-methylbutyl)-N'-(4-methylphenyl)-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-(2-methylbutyl)-N'-(4-methylphenyl)-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}urea
N-(2-methylbutyl)-N'-(4-methylphenyl)-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: | V022-0623 |
| Compound Name: | N-(2-methylbutyl)-N'-(4-methylphenyl)-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: | 547.76 |
| Molecular Formula: | C32 H41 N3 O3 S |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)C(C)C)=O)C(Nc1ccc(C)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.9172 |
| logD: | 7.9172 |
| logSw: | -5.6904 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.107 |
| InChI Key: | LTJHVNXMWWVRAQ-UHFFFAOYSA-N |