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873303-30-1 | Methanone, 2,6-pyridinediylbis[[4-(4-aminophenoxy)phenyl]-
CAS No: 873303-30-1 Catalog No: AG004L1U MDL No:
Product Description
Catalog Number:
AG004L1U
Chemical Name:
Methanone, 2,6-pyridinediylbis[[4-(4-aminophenoxy)phenyl]-
CAS Number:
873303-30-1
Molecular Formula:
C31H23N3O4
Molecular Weight:
501.5320
IUPAC Name:
[6-[4-(4-aminophenoxy)benzoyl]pyridin-2-yl]-[4-(4-aminophenoxy)phenyl]methanone
InChI:
InChI=1S/C31H23N3O4/c32-22-8-16-26(17-9-22)37-24-12-4-20(5-13-24)30(35)28-2-1-3-29(34-28)31(36)21-6-14-25(15-7-21)38-27-18-10-23(33)11-19-27/h1-19H,32-33H2
InChI Key:
RXSYQQXZRXORBE-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(n1)C(=O)c1ccc(cc1)Oc1ccc(cc1)N)c1ccc(cc1)Oc1ccc(cc1)N
Properties
Complexity:
699
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
501.169g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
501.542g/mol
Monoisotopic Mass:
501.169g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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