| CAS Number | 60285-94-1 |
| Catalog Number | AG00EJDU(AGN-PC-0SVKQ1) |
| Chemical Name | H-Arg-4MbetaNA |
| IUPAC Name | (2S)-2-amino-5-(diaminomethylideneamino)-N-(4-methoxynaphthalen-2-yl)pentanamide |
| InChI | InChI=1S/C17H23N5O2/c1-24-15-10-12(9-11-5-2-3-6-13(11)15)22-16(23)14(18)7-4-8-21-17(19)20/h2-3,5-6,9-10,14H,4,7-8,18H2,1H3,(H,22,23)(H4,19,20,21)/t14-/m0/s1 |
| InChI Key | XVHWVDFGKDNOBO-AWEZNQCLSA-N |
| MDL Number | MFCD00038393 |
| Molecular Formula | C17H23N5O2 |
| Molecular Weight | 329.3968 |
| SMILES | O(C1=CC(NC(=O)[C@@H](N)CCCNC(N)=N)=CC2=CC=CC=C12)C |
| Synonyms | H-Arg-4MbetaNA,
H-Arg-4M|ANA,
60285-94-1,
Arg-MNA,
R-MNA,
Arg-4-Methoxy-2-Naphthylamine,
Arg-betaNa,
H-Arg-4MbNA,
SCHEMBL1514737,
ZINC2522629,
l-arginine-4-methoxy-2-naphthylamide,
HY-112688,
CS-0062640,
H-arg-4m?na(hydrochloride Salt),
|
| Complexity | 439 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 329.185g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.404g/mol |
| Monoisotopic Mass | 329.185g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 129A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number