N'-(propan-2-yl)-N-[(2-{[2-(propan-2-yl)phenoxy]methyl}-1,3-thiazol-4-yl)methyl]-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N'-(propan-2-yl)-N-[(2-{[2-(propan-2-yl)phenoxy]methyl}-1,3-thiazol-4-yl)methyl]-N-(prop-2-en-1-yl)urea
N'-(propan-2-yl)-N-[(2-{[2-(propan-2-yl)phenoxy]methyl}-1,3-thiazol-4-yl)methyl]-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V025-8857 |
| Compound Name: | N'-(propan-2-yl)-N-[(2-{[2-(propan-2-yl)phenoxy]methyl}-1,3-thiazol-4-yl)methyl]-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 387.54 |
| Molecular Formula: | C21 H29 N3 O2 S |
| Smiles: | CC(C)c1ccccc1OCc1nc(CN(CC=C)C(NC(C)C)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 5.197 |
| logD: | 5.197 |
| logSw: | -5.0618 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.127 |
| InChI Key: | JXXAAFOOAFFJDK-UHFFFAOYSA-N |