| CAS Number | 1423037-26-6 |
| Catalog Number | AG00HWGU(AGN-PC-0WO9RL) |
| Chemical Name | Z-N-Cyclopropyl-L-Isoleucinamide |
| IUPAC Name | benzyl N-[1-(cyclopropylamino)-3-methyl-1-oxopentan-2-yl]carbamate |
| InChI | InChI=1S/C17H24N2O3/c1-3-12(2)15(16(20)18-14-9-10-14)19-17(21)22-11-13-7-5-4-6-8-13/h4-8,12,14-15H,3,9-11H2,1-2H3,(H,18,20)(H,19,21) |
| InChI Key | ATTATPNXUUJVLD-UHFFFAOYSA-N |
| MDL Number | MFCD29764214 |
| Molecular Formula | C17H24N2O3 |
| Molecular Weight | 304.3841 |
| SMILES | CCC(C(C(=O)NC1CC1)NC(=O)OCc1ccccc1)C |
| Synonyms | 1423037-26-6,
Benzyl ((2R,3R)-rel-1-(cyclopropylamino)-3-methyl-1-oxopentan-2-yl)carbamate,
Z-N-Cyclopropyl-L-Isoleucinamide,
AKOS034144431,
MCULE-9398692055,
Z30839735,
benzyl N-[1-(cyclopropylcarbamoyl)-2-methylbutyl]carbamate,
1103867-45-3,
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| Complexity | 376 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.39g/mol |
| Monoisotopic Mass | 304.179g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number