2-[(2-hydroxyhex-5-en-1-yl)(3-methoxypropyl)amino]-1-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
2-[(2-hydroxyhex-5-en-1-yl)(3-methoxypropyl)amino]-1-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
2-[(2-hydroxyhex-5-en-1-yl)(3-methoxypropyl)amino]-1-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | V029-9454 |
| Compound Name: | 2-[(2-hydroxyhex-5-en-1-yl)(3-methoxypropyl)amino]-1-{4-[(4-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
| Molecular Weight: | 486.67 |
| Molecular Formula: | C27 H38 N2 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)OCC1c2ccsc2CCN1C(CN(CCCOC)CC(CCC=C)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4557 |
| logD: | 4.4498 |
| logSw: | -4.0881 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.999 |
| InChI Key: | DRFBBWAGVGCLOR-UHFFFAOYSA-N |