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1227962-62-0 | Methanone, 1,1'-(4,4',5,5'-tetrachloro[1,3'-bi-1H-pyrrole]-2,2'-diyl)bis[1-(2-hydroxyphenyl)-
CAS No: 1227962-62-0 Catalog No: AG000JH5 MDL No:
Product Description
Catalog Number:
AG000JH5
Chemical Name:
Methanone, 1,1'-(4,4',5,5'-tetrachloro[1,3'-bi-1H-pyrrole]-2,2'-diyl)bis[1-(2-hydroxyphenyl)-
CAS Number:
1227962-62-0
Molecular Formula:
C22H12Cl4N2O4
Molecular Weight:
510.1537
IUPAC Name:
[4,5-dichloro-1-[4,5-dichloro-2-(2-hydroxybenzoyl)-1H-pyrrol-3-yl]pyrrol-2-yl]-(2-hydroxyphenyl)methanone
InChI:
InChI=1S/C22H12Cl4N2O4/c23-12-9-13(19(31)10-5-1-3-7-14(10)29)28(22(12)26)18-16(24)21(25)27-17(18)20(32)11-6-2-4-8-15(11)30/h1-9,27,29-30H
InChI Key:
QYPJBTMRYKRTFG-UHFFFAOYSA-N
SMILES:
Clc1[nH]c(c(c1Cl)n1c(cc(c1Cl)Cl)C(=O)c1ccccc1O)C(=O)c1ccccc1O
Properties
Complexity:
715
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
509.952g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
510.148g/mol
Monoisotopic Mass:
507.955g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
95.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
Literature
| Title | Journal |
|---|---|
| Marinopyrrole derivatives as potential antibiotic agents against methicillin-resistant Staphylococcus aureus (I). | Marine drugs 20120401 |
| Discovery of marinopyrrole A (maritoclax) as a selective Mcl-1 antagonist that overcomes ABT-737 resistance by binding to and targeting Mcl-1 for proteasomal degradation. | The Journal of biological chemistry 20120323 |
| Total synthesis of (±)-marinopyrrole A via copper-mediated N-arylation. | Organic letters 20101105 |
| Structures, reactivities, and antibiotic properties of the marinopyrroles A-F. | The Journal of organic chemistry 20100521 |
| Marinopyrrole A target elucidation by acyl dye transfer. | Journal of the American Chemical Society 20090902 |
| The marinopyrroles, antibiotics of an unprecedented structure class from a marine Streptomyces sp. | Organic letters 20080221 |
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