| CAS Number | 1092523-24-4 |
| Catalog Number | AG008WQH(AGN-PC-0WBNMJ) |
| Chemical Name | 2-Amino-7-chloro-1-ethyl-N-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide |
| IUPAC Name | 2-amino-7-chloro-1-ethyl-N-methyl-4-oxo-1,8-naphthyridine-3-carboxamide |
| InChI | InChI=1S/C12H13ClN4O2/c1-3-17-10(14)8(12(19)15-2)9(18)6-4-5-7(13)16-11(6)17/h4-5H,3,14H2,1-2H3,(H,15,19) |
| InChI Key | YKTHWJYNEJKGFD-UHFFFAOYSA-N |
| MDL Number | MFCD22571280 |
| Molecular Formula | C12H13ClN4O2 |
| Molecular Weight | 280.7102 |
| SMILES | NC1=C(C(NC)=O)C(C2=CC=C(Cl)N=C2N1CC)=O |
| Synonyms | 2-Amino-7-chloro-1-ethyl-N-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide,
1092523-24-4,
YKTHWJYNEJKGFD-UHFFFAOYSA-N,
SCHEMBL1570479,
2-amino-7-chloro-1-ethyl-N-methyl-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxamide,
2-amino-7-chloro-1-ethyl-N-methyl-4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxamide,
|
| Complexity | 437 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.712g/mol |
| Monoisotopic Mass | 280.073g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number