| CAS Number | 1375466-18-4 |
| Catalog Number | AG00A138(AGN-PC-0WNWFZ) |
| Chemical Name | 2-[1-(3-Fluoro-phenyl)-cyclohexylamino]-pyrimidine-5-carboxylic acid hydroxyamide |
| IUPAC Name | 2-[[1-(3-fluorophenyl)cyclohexyl]amino]-N-hydroxypyrimidine-5-carboxamide |
| InChI | InChI=1S/C17H19FN4O2/c18-14-6-4-5-13(9-14)17(7-2-1-3-8-17)21-16-19-10-12(11-20-16)15(23)22-24/h4-6,9-11,24H,1-3,7-8H2,(H,22,23)(H,19,20,21) |
| InChI Key | IYBURCQQEUNLDL-UHFFFAOYSA-N |
| MDL Number | MFCD30533691 |
| Molecular Formula | C17H19FN4O2 |
| Molecular Weight | 330.3568 |
| SMILES | FC=1C=C(C=CC1)C1(CCCCC1)NC1=NC=C(C=N1)C(=O)NO |
| Synonyms | 2-((1-(3-fluorophenyl)cyclohexyl)amino)-N-hydroxypyrimidine-5-carboxamide,
ACY-775,
ACY-775,
1375466-18-4,
SCHEMBL4729593,
CHEMBL3655978,
IYBURCQQEUNLDL-UHFFFAOYSA-N,
BDBM139323,
EX-A1090,
CS-7689,
HY-19328,
US8614223, 101,
2-((1-(3-fluorophenyl)cyclohexyl)amino)-N-hydroxypyrimidine-5-carboxamide,
2-[1-(3-Fluoro-phenyl)-cyclohexylamino]-pyrimidine-5-carboxylic acid hydroxyamide,
|
| Complexity | 423 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 330.149g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 330.363g/mol |
| Monoisotopic Mass | 330.149g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 87.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number