| CAS Number | 2009273-71-4 |
| Catalog Number | AG01DUAG |
| Chemical Name | GNE-6776 |
| IUPAC Name | 5-[6-amino-4-ethyl-5-(4-hydroxyphenyl)pyridin-3-yl]-N-methylpyridine-2-carboxamide |
| InChI | InChI=1S/C20H20N4O2/c1-3-15-16(13-6-9-17(23-10-13)20(26)22-2)11-24-19(21)18(15)12-4-7-14(25)8-5-12/h4-11,25H,3H2,1-2H3,(H2,21,24)(H,22,26) |
| InChI Key | UCYSSYGGXOFJKK-UHFFFAOYSA-N |
| MDL Number | MFCD31657364 |
| Molecular Formula | C20H20N4O2 |
| Molecular Weight | 348.3984 |
| SMILES | O=C(C1=CC=C(C2=C(CC)C(C3=CC=C(O)C=C3)=C(N)N=C2)C=N1)NC |
| Synonyms | 5-(6-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridyl-N-methylpyridine-2-carboxamide,
GNE-6776,
GNE-6776,
2009273-71-4,
6'-Amino-4'-Ethyl-5'-(4-Hydroxyphenyl)-N-Methyl[3,3'-Bipyridine]-6-Carboxamide,
CHEMBL4092976,
SCHEMBL18066783,
GEN6776,
UCYSSYGGXOFJKK-UHFFFAOYSA-N,
HY-107986,
AK00799505,
CS-0031103,
5-[6-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridyl]-N-methyl-pyridine-2-carboxamide,
6'-amino-4'-ethyl-5'-(4-hydroxyphenyl)-N-methyl-[3,3'-bipyridine]-6-carboxamide,
2009273-60-1,
8JP,
445295-04-5,
|
| Complexity | 467 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 348.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.406g/mol |
| Monoisotopic Mass | 348.159g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 101A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
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