N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V015-6523 |
| Compound Name: | N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 469.65 |
| Molecular Formula: | C26 H35 N3 O3 S |
| Smiles: | CC(C)c1ccc(cc1)OCC1c2ccsc2CCN1C(CN(CC=C)C(NC(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4611 |
| logD: | 5.4611 |
| logSw: | -5.3807 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.653 |
| InChI Key: | DAIIBYKIQGLJDI-QHCPKHFHSA-N |