2-[(cyclopropylmethyl){2-hydroxy-3-[(propan-2-yl)oxy]propyl}amino]-1-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Chemical Structure Depiction of
2-[(cyclopropylmethyl){2-hydroxy-3-[(propan-2-yl)oxy]propyl}amino]-1-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
2-[(cyclopropylmethyl){2-hydroxy-3-[(propan-2-yl)oxy]propyl}amino]-1-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one
Compound characteristics
Compound ID: | V016-5111 |
Compound Name: | 2-[(cyclopropylmethyl){2-hydroxy-3-[(propan-2-yl)oxy]propyl}amino]-1-{4-[(4-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}ethan-1-one |
Molecular Weight: | 490.64 |
Molecular Formula: | C26 H35 F N2 O4 S |
Salt: | not_available |
Smiles: | CC(C)OCC(CN(CC1CC1)CC(N1CCc2c(ccs2)C1COc1ccc(cc1)F)=O)O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.1391 |
logD: | 4.0464 |
logSw: | -4.0717 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.212 |
InChI Key: | BJPMZBVDTOYAQI-UHFFFAOYSA-N |