(S)-4-[2-[1-(tert-Butoxycarbonyl)-2-pyrrolidinyl]-5-imidazolyl]phenylboronic Acid Pinacol Ester - CAS 1007882-12-3
Catalog: |
BB000339 |
Product Name: |
(S)-4-[2-[1-(tert-Butoxycarbonyl)-2-pyrrolidinyl]-5-imidazolyl]phenylboronic Acid Pinacol Ester |
CAS: |
1007882-12-3 |
Synonyms: |
(2S)-2-[5-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-imidazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl (2S)-2-[5-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-imidazol-2-yl]pyrrolidine-1-carboxylate |
IUPAC Name: | tert-butyl (2S)-2-[5-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-imidazol-2-yl]pyrrolidine-1-carboxylate |
Description: | (S)-4-[2-[1-(tert-Butoxycarbonyl)-2-pyrrolidinyl]-5-imidazolyl]phenylboronic Acid Pinacol Ester (CAS# 1007882-12-3 ) is a useful research chemical. |
Molecular Weight: | 439.36 |
Molecular Formula: | C24H34N3O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3=CN=C(N3)C4CCCN4C(=O)OC(C)(C)C |
InChI: | InChI=1S/C24H34BN3O4/c1-22(2,3)30-21(29)28-14-8-9-19(28)20-26-15-18(27-20)16-10-12-17(13-11-16)25-31-23(4,5)24(6,7)32-25/h10-13,15,19H,8-9,14H2,1-7H3,(H,26,27)/t19-/m0/s1 |
InChI Key: | UFFNRFDGLUNWDL-IBGZPJMESA-N |
MDL: | MFCD20527700 |
LogP: | 4.38580 |
Publication Number | Title | Priority Date |
TW-201716395-A | HCV inhibitors, preparation method and use thereof | 20151106 |
JP-2017513852-A | Potent and selective inhibitors of hepatitis C virus | 20140415 |
US-2017029407-A1 | Potent and selective inhibitors of hepatitis c virus | 20140415 |
US-9926295-B2 | Potent and selective inhibitors of hepatitis C virus | 20140415 |
EP-3091010-A1 | 9,9,10,10-tetrafluoro-9,10-dihydrophenanthrene hepatitis c virus inhibitor and application thereof | 20131231 |
Complexity: | 671 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 439.2642367 |
Formal Charge: | 0 |
Heavy Atom Count: | 32 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 439.2642367 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 76.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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