| CAS Number | 1251578-67-2 |
| Catalog Number | AG01APHZ(AGN-PC-0WCOGV) |
| Chemical Name | N-(4-Fluorophenyl)-6-morpholino-9h-purin-2-amine |
| IUPAC Name | N-(4-fluorophenyl)-6-morpholin-4-yl-7H-purin-2-amine |
| InChI | InChI=1S/C15H15FN6O/c16-10-1-3-11(4-2-10)19-15-20-13-12(17-9-18-13)14(21-15)22-5-7-23-8-6-22/h1-4,9H,5-8H2,(H2,17,18,19,20,21) |
| InChI Key | KPXPXKOSEYWROL-UHFFFAOYSA-N |
| MDL Number | MFCD22608428 |
| Molecular Formula | C15H15FN6O |
| Molecular Weight | 314.3176 |
| SMILES | FC1=CC=C(NC2=NC3=C(N=CN3)C(N3CCOCC3)=N2)C=C1 |
| Synonyms | N-(4-fluorophenyl)-6-morpholino-9H-purin-2-amine,
1251578-67-2,
ZINC56907343,
AKOS024528307,
MCULE-7914618851,
VU0528858-1,
SR-01000926353,
SR-01000926353-1,
F5955-0065,
N-(4-fluorophenyl)-6-morpholin-4-yl-7H-purin-2-amine,
|
| Complexity | 388 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 314.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 314.324g/mol |
| Monoisotopic Mass | 314.129g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 79A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number