1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxypentyl)(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-hydroxypentyl)(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-hydroxypentyl)(prop-2-en-1-yl)amino]ethan-1-one
Compound characteristics
| Compound ID: | V017-2509 |
| Compound Name: | 1-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-[(2-hydroxypentyl)(prop-2-en-1-yl)amino]ethan-1-one |
| Molecular Weight: | 456.65 |
| Molecular Formula: | C26 H36 N2 O3 S |
| Salt: | not_available |
| Smiles: | CCCC(CN(CC=C)CC(N1CCc2c(ccs2)C1COc1ccc(C)cc1C)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4326 |
| logD: | 5.4316 |
| logSw: | -5.2679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.743 |
| InChI Key: | UKQMKUDCZGKIEF-UHFFFAOYSA-N |