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Home > Pyridines > 1803598-76-6
1803598-76-6 | 2-[(2-methylphenyl)sulfanyl]-N-[4-(pyridin-4-yloxy)phenyl]acetamide
CAS No: 1803598-76-6 Catalog No: AG01BCNP MDL No:MFCD28954201
Product Description
Catalog Number:
AG01BCNP
Chemical Name:
2-[(2-methylphenyl)sulfanyl]-N-[4-(pyridin-4-yloxy)phenyl]acetamide
CAS Number:
1803598-76-6
Molecular Formula:
C20H18N2O2S
Molecular Weight:
350.4341
MDL Number:
MFCD28954201
IUPAC Name:
2-(2-methylphenyl)sulfanyl-N-(4-pyridin-4-yloxyphenyl)acetamide
InChI:
InChI=1S/C20H18N2O2S/c1-15-4-2-3-5-19(15)25-14-20(23)22-16-6-8-17(9-7-16)24-18-10-12-21-13-11-18/h2-13H,14H2,1H3,(H,22,23)
InChI Key:
FMNCRWOPBFFOOB-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)Oc1ccncc1)CSc1ccccc1C
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.109g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.436g/mol
Monoisotopic Mass:
350.109g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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