| CAS Number | 866050-49-9 |
| Catalog Number | AG00IV1R(AGN-PC-0WAVJG) |
| Chemical Name | 2-(4-Fluorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-ol |
| IUPAC Name | 2-(4-fluorophenyl)-7-methyl-8H-imidazo[1,2-a]pyrimidin-5-one |
| InChI | InChI=1S/C13H10FN3O/c1-8-6-12(18)17-7-11(16-13(17)15-8)9-2-4-10(14)5-3-9/h2-7H,1H3,(H,15,16) |
| InChI Key | HFQXUTRDMNEUJM-UHFFFAOYSA-N |
| MDL Number | MFCD04125870 |
| Molecular Formula | C13H10FN3O |
| Molecular Weight | 243.2364 |
| SMILES | FC1=CC=C(C=C1)C=1N=C2N(C(=CC(=N2)C)O)C1 |
| Synonyms | 2-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyrimidin-5-ol,
866050-49-9,
AC1LS3RI,
KS-00001YX1,
MFCD04125870,
AKOS005099184,
ZINC100919975,
MCULE-8109457677,
6W-0819,
SR-01000309291,
SR-01000309291-1,
2-(4-fluorophenyl)-7-methyl-8H-imidazo[1,2-a]pyrimidin-5-one,
CID1481880,
8-(4-fluorophenyl)-4-methyl-1,5,7-triazabicyclo[4.3.0]nona-3,6,8-trien-2-one,
|
| Complexity | 376 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.241g/mol |
| Monoisotopic Mass | 243.081g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number