| CAS Number | 1955550-51-2 |
| Catalog Number | AG01EOQL(AGN-PC-0WOH65) |
| Chemical Name | FMK 9a |
| IUPAC Name | N-[(2S)-1-[(3-fluoro-2-oxopropyl)amino]-1-oxo-3-phenylpropan-2-yl]naphthalene-1-carboxamide |
| InChI | InChI=1S/C23H21FN2O3/c24-14-18(27)15-25-23(29)21(13-16-7-2-1-3-8-16)26-22(28)20-12-6-10-17-9-4-5-11-19(17)20/h1-12,21H,13-15H2,(H,25,29)(H,26,28)/t21-/m0/s1 |
| InChI Key | VMVOHHPQIAPYHG-NRFANRHFSA-N |
| MDL Number | MFCD31382128 |
| Molecular Formula | C23H21FN2O3 |
| Molecular Weight | 392.4228 |
| SMILES | C1C=CC=CC=1C[C@@H](C(NCC(=O)CF)=O)NC(C1C=CC=C2C=CC=CC=12)=O |
| Synonyms | FMK 9a,
1955550-51-2,
ZINC669678975,
CS-6472,
HY-100522,
|
| Complexity | 577 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 392.153621g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 392.4g/mol |
| Monoisotopic Mass | 392.153621g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 75.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
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Certificate of Analysis
Lot Number