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Home > Pyridines > 874906-91-9
874906-91-9 | Pyridine, 3,5-bis(phenyl-1H-pyrrol-2-ylmethyl)-
CAS No: 874906-91-9 Catalog No: AG004FKU MDL No:
Product Description
Catalog Number:
AG004FKU
Chemical Name:
Pyridine, 3,5-bis(phenyl-1H-pyrrol-2-ylmethyl)-
CAS Number:
874906-91-9
Molecular Formula:
C27H23N3
Molecular Weight:
389.4916
IUPAC Name:
3,5-bis[phenyl(1H-pyrrol-2-yl)methyl]pyridine
InChI:
InChI=1S/C27H23N3/c1-3-9-20(10-4-1)26(24-13-7-15-29-24)22-17-23(19-28-18-22)27(25-14-8-16-30-25)21-11-5-2-6-12-21/h1-19,26-27,29-30H
InChI Key:
QUYWISLZIZBFJZ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C(c1[nH]ccc1)c1cncc(c1)C(c1[nH]ccc1)c1ccccc1
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.189g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
389.502g/mol
Monoisotopic Mass:
389.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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