| CAS Number | 1393445-24-3 |
| Catalog Number | AG009X59(AGN-PC-0WAEJK) |
| Chemical Name | N-Cyclopropyl L-Z-Valinamide |
| IUPAC Name | benzyl N-[(2S)-1-(cyclopropylamino)-3-methyl-1-oxobutan-2-yl]carbamate |
| InChI | InChI=1S/C16H22N2O3/c1-11(2)14(15(19)17-13-8-9-13)18-16(20)21-10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3,(H,17,19)(H,18,20)/t14-/m0/s1 |
| InChI Key | GAJOCJBVEJLKMJ-AWEZNQCLSA-N |
| MDL Number | MFCD22383737 |
| Molecular Formula | C16H22N2O3 |
| Molecular Weight | 290.3575 |
| SMILES | CC(C(C(=O)NC1CC1)NC(=O)OCc1ccccc1)C |
| Synonyms | N-Cyclopropyl L-Z-Valinamide,
1393445-24-3,
AC1PNIIL,
N-Cbz-L-N'-cyclopropylvalinamide,
ZINC8077153,
V2972,
B-9363,
benzyl N-[(2S)-1-(cyclopropylamino)-3-methyl-1-oxobutan-2-yl]carbamate,
C16H22N2O3,
ZINC08077153,
CID9210046,
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| Complexity | 361 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.363g/mol |
| Monoisotopic Mass | 290.163g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number