1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxyhex-5-en-1-yl)(prop-2-en-1-yl)amino]ethan-1-one
					Chemical Structure Depiction of
1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxyhex-5-en-1-yl)(prop-2-en-1-yl)amino]ethan-1-one
			1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxyhex-5-en-1-yl)(prop-2-en-1-yl)amino]ethan-1-one
Compound characteristics
| Compound ID: | V002-4363 | 
| Compound Name: | 1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxyhex-5-en-1-yl)(prop-2-en-1-yl)amino]ethan-1-one | 
| Molecular Weight: | 468.66 | 
| Molecular Formula: | C27 H36 N2 O3 S | 
| Salt: | not_available | 
| Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(CC=C)CC(CCC=C)O)=O | 
| Stereo: | MIXTURE OF STEREOISOMERS | 
| logP: | 5.6173 | 
| logD: | 5.6145 | 
| logSw: | -5.3194 | 
| Hydrogen bond acceptors count: | 5 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 44.743 | 
| InChI Key: | KAJHCCPNMSSLLJ-UHFFFAOYSA-N | 
 
				 
				