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821784-66-1 | Phenol, 5-[[[5-(4-hydroxyphenyl)-3-pyridinyl]amino]methyl]-2-methoxy-
CAS No: 821784-66-1 Catalog No: AG005I6L MDL No:
Product Description
Catalog Number:
AG005I6L
Chemical Name:
Phenol, 5-[[[5-(4-hydroxyphenyl)-3-pyridinyl]amino]methyl]-2-methoxy-
CAS Number:
821784-66-1
Molecular Formula:
C19H18N2O3
Molecular Weight:
322.3578
IUPAC Name:
5-[[[5-(4-hydroxyphenyl)pyridin-3-yl]amino]methyl]-2-methoxyphenol
InChI:
InChI=1S/C19H18N2O3/c1-24-19-7-2-13(8-18(19)23)10-21-16-9-15(11-20-12-16)14-3-5-17(22)6-4-14/h2-9,11-12,21-23H,10H2,1H3
InChI Key:
VXOJKQCKVXCNRQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1O)CNc1cncc(c1)c1ccc(cc1)O
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.132g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
322.364g/mol
Monoisotopic Mass:
322.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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