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}-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
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}-N-(prop-2-en-1-yl)urea
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}-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V022-0699 |
| Compound Name: | 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}-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 517.69 |
| Molecular Formula: | C30 H35 N3 O3 S |
| Smiles: | CC(C)c1ccc(cc1)OCC1c2ccsc2CCN1C(CN(CC=C)C(Nc1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6661 |
| logD: | 6.6661 |
| logSw: | -5.6392 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.085 |
| InChI Key: | UZOHCRUAAMQXGX-MHZLTWQESA-N |