| CAS Number | 82611-49-2 |
| Catalog Number | AG00G8SM(AGN-PC-0UMNZJ) |
| Chemical Name | D-Lysine, n2-[(1,1-dimethylethoxy)carbonyl]-n6-[(phenylmethoxy)carbonyl]-, methyl ester |
| IUPAC Name | methyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate |
| InChI | InChI=1S/C20H30N2O6/c1-20(2,3)28-19(25)22-16(17(23)26-4)12-8-9-13-21-18(24)27-14-15-10-6-5-7-11-15/h5-7,10-11,16H,8-9,12-14H2,1-4H3,(H,21,24)(H,22,25)/t16-/m1/s1 |
| InChI Key | PUJVYJATJHQXRX-MRXNPFEDSA-N |
| MDL Number | MFCD17019207 |
| Molecular Formula | C20H30N2O6 |
| Molecular Weight | 394.4620 |
| SMILES | COC(=O)[C@H](NC(=O)OC(C)(C)C)CCCCNC(=O)OCc1ccccc1 |
| Synonyms | 82611-49-2,
D-Lysine, N2-[(1,1-dimethylethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]-, methyl ester,
D-Lysine,N2-[(1,1-dimethyl ethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]-,methyl ester,
CZ-159,
ZINC36435052,
AKOS015918006,
DB-012392,
FT-0772141,
I14-8947,
Z-D-LYS(BOC)-OME,
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| Complexity | 497 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 394.21g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 394.468g/mol |
| Monoisotopic Mass | 394.21g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 103A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number