(S)-1-Boc-2-(4-iodo-2-imidazolyl)pyrrolidine - CAS 1228552-62-2
Catalog: |
BB005539 |
Product Name: |
(S)-1-Boc-2-(4-iodo-2-imidazolyl)pyrrolidine |
CAS: |
1228552-62-2 |
Synonyms: |
(2S)-2-(5-iodo-1H-imidazol-2-yl)-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl (2S)-2-(5-iodo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate |
IUPAC Name: | tert-butyl (2S)-2-(5-iodo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate |
Description: | (S)-1-Boc-2-(4-iodo-2-imidazolyl)pyrrolidine (CAS# 1228552-62-2 ) is a useful research chemical. |
Molecular Weight: | 363.19 |
Molecular Formula: | C12H18IN3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCCC1C2=NC=C(N2)I |
InChI: | InChI=1S/C12H18IN3O2/c1-12(2,3)18-11(17)16-6-4-5-8(16)10-14-7-9(13)15-10/h7-8H,4-6H2,1-3H3,(H,14,15)/t8-/m0/s1 |
InChI Key: | NSXDWECYTNLRMJ-QMMMGPOBSA-N |
LogP: | 3.02420 |
Publication Number | Title | Priority Date |
RU-2669919-C1 | Pan-genomic inhibitors of the hepatitis c virus protein ns5a, pharmaceutical compositions, intermediates for the synthesis of inhibitors, and methods for their preparation and use | 20150904 |
US-2017066746-A1 | Pan-genomic inhibitors of NS5A protein encoded by HCV, pharmaceutical compositions, intermediates for inhibitor synthesis, and their synthesis and application methods | 20150904 |
US-9790207-B2 | Pan-genomic inhibitors of NS5A protein encoded by HCV, pharmaceutical compositions, intermediates for inhibitor synthesis, and their synthesis and application methods | 20150904 |
WO-2017039791-A1 | Pan-genomic inhibitors of ns5a protein encoded by hcv, pharmaceutical compositions, intermediates for inhibitor synthesis, and their synthesis and application methods. | 20150904 |
WO-2014131315-A1 | Bridged ring compounds as hepatitis c virus inhibitors, pharmaceutical compositions and uses thereof | 20130227 |
Complexity: | 319 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 363.04437 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 363.04437 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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