Diethyl 1,4-dihydro-2,6-dimethyl-4-(4-fluorophenyl)-3,5-pyridinedicarboxylate - CAS 58395-00-9
Catalog: |
BB030024 |
Product Name: |
Diethyl 1,4-dihydro-2,6-dimethyl-4-(4-fluorophenyl)-3,5-pyridinedicarboxylate |
CAS: |
58395-00-9 |
Synonyms: |
diethyl 4-(4-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
IUPAC Name: | diethyl 4-(4-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
Description: | Diethyl 1,4-dihydro-2,6-dimethyl-4-(4-fluorophenyl)-3,5-pyridinedicarboxylate (CAS# 58395-00-9 ) is a useful research chemical. |
Molecular Weight: | 347.38 |
Molecular Formula: | C19H22FNO4 |
Canonical SMILES: | CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)F)C(=O)OCC)C)C |
InChI: | InChI=1S/C19H22FNO4/c1-5-24-18(22)15-11(3)21-12(4)16(19(23)25-6-2)17(15)13-7-9-14(20)10-8-13/h7-10,17,21H,5-6H2,1-4H3 |
InChI Key: | AITJZYHNAKUCFP-UHFFFAOYSA-N |
MDL: | MFCD00184778 |
LogP: | 3.51550 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20090059569-A | Compounds and Methods for Identifying Compounds for Inhibition of Beta-amyloid Production | 20071207 |
US-2010119599-A1 | Polyhydroquinoline compounds and dihydropyridine compounds for inhibiting beta-amyloid production | 20061208 |
AU-2007269090-A1 | Compounds and combinations thereof for inhibiting beta-amyloid production and methods of use thereof | 20060706 |
CA-2655029-A1 | Compounds and combinations thereof for inhibiting beta-amyloid production and methods of use thereof | 20060706 |
KR-20090026275-A | Compounds and combinations thereof for inhibiting beta-amyloid production, and methods of use thereof | 20060706 |
Complexity: | 548 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 347.15328635 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 347.15328635 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 64.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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