5-(4-Chlorophenyl)-4-(3-iodophenyl)-1,2-dimethylpyrrole-3-carboxylic Acid - CAS 1305320-66-4
Catalog: |
BB007128 |
Product Name: |
5-(4-Chlorophenyl)-4-(3-iodophenyl)-1,2-dimethylpyrrole-3-carboxylic Acid |
CAS: |
1305320-66-4 |
Synonyms: |
5-(4-chlorophenyl)-4-(3-iodophenyl)-1,2-dimethyl-3-pyrrolecarboxylic acid; 5-(4-chlorophenyl)-4-(3-iodophenyl)-1,2-dimethylpyrrole-3-carboxylic acid |
IUPAC Name: | 5-(4-chlorophenyl)-4-(3-iodophenyl)-1,2-dimethylpyrrole-3-carboxylic acid |
Description: | 5-(4-Chlorophenyl)-4-(3-iodophenyl)-1,2-dimethylpyrrole-3-carboxylic Acid (CAS# 1305320-66-4 ) is a useful research chemical. |
Molecular Weight: | 451.69 |
Molecular Formula: | C19H15ClINO2 |
Canonical SMILES: | CC1=C(C(=C(N1C)C2=CC=C(C=C2)Cl)C3=CC(=CC=C3)I)C(=O)O |
InChI: | InChI=1S/C19H15ClINO2/c1-11-16(19(23)24)17(13-4-3-5-15(21)10-13)18(22(11)2)12-6-8-14(20)9-7-12/h3-10H,1-2H3,(H,23,24) |
InChI Key: | JJCGFEKHEVDOKO-UHFFFAOYSA-N |
LogP: | 5.62370 |
Publication Number | Title | Priority Date |
EP-2668180-B1 | Bcl-2/bcl-xl inhibitors for use in the treatment of cancer | 20110125 |
EP-3459945-A1 | Bcl-2/bcl-xl inhibitors for use in the treatment of cancer | 20110125 |
US-2012189539-A1 | Bcl-2/bcl-xl inhibitors and therapeutic methods using the same | 20110125 |
US-8691184-B2 | Bcl-2/Bcl-xL inhibitors and therapeutic methods using the same | 20110125 |
WO-2012103059-A2 | Bcl-2/bcl-xl inhibitors and therapeutic methods using the same | 20110125 |
Complexity: | 455 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 450.9836 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 450.9836 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 42.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.2 |
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