2-(cyclopropyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)-1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
2-(cyclopropyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)-1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
2-(cyclopropyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)-1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | V020-3668 |
| Compound Name: | 2-(cyclopropyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)-1-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
| Molecular Weight: | 474.59 |
| Molecular Formula: | C25 H31 F N2 O4 S |
| Salt: | not_available |
| Smiles: | C=CCOCC(CN(CC(N1CCc2c(ccs2)C1COc1cccc(c1)F)=O)C1CC1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6039 |
| logD: | 3.6036 |
| logSw: | -3.7025 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.227 |
| InChI Key: | NYVQDPNVDHMBKT-UHFFFAOYSA-N |