| CAS Number | 929621-79-4 |
| Catalog Number | AG01EO33(AGN-PC-3H466A) |
| Chemical Name | Ac-Leu-Arg-AMC |
| IUPAC Name | 2-acetamido-N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]-4-methylpentanamide |
| InChI | InChI=1S/C24H34N6O5/c1-13(2)10-19(28-15(4)31)23(34)30-18(6-5-9-27-24(25)26)22(33)29-16-7-8-17-14(3)11-21(32)35-20(17)12-16/h7-8,11-13,18-19H,5-6,9-10H2,1-4H3,(H,28,31)(H,29,33)(H,30,34)(H4,25,26,27) |
| InChI Key | YAPHUDCEMGABMM-UHFFFAOYSA-N |
| MDL Number | MFCD31619311 |
| Molecular Formula | C24H34N6O5 |
| Molecular Weight | 486.5640 |
| SMILES | CC1=CC(=O)OC2=CC(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)C)=CC=C12 |
| Synonyms | Ac-Leu-Arg-AMC,
929621-79-4,
|
| Complexity | 851 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 486.259g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 35 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 486.573g/mol |
| Monoisotopic Mass | 486.259g/mol |
| Rotatable Bond Count | 11 |
| Topological Polar Surface Area | 178A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Certificate of Analysis
Lot Number