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303163-11-3 | 2-Pyridinamine, 4-[2-(4-fluorophenyl)-4-(3-methylphenyl)-5-thiazolyl]-N-(3-phenylpropyl)-
CAS No: 303163-11-3 Catalog No: AG002ZQQ MDL No:
Product Description
Catalog Number:
AG002ZQQ
Chemical Name:
2-Pyridinamine, 4-[2-(4-fluorophenyl)-4-(3-methylphenyl)-5-thiazolyl]-N-(3-phenylpropyl)-
CAS Number:
303163-11-3
Molecular Formula:
C30H26FN3S
Molecular Weight:
479.6109
IUPAC Name:
4-[2-(4-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-5-yl]-N-(3-phenylpropyl)pyridin-2-amine
InChI:
InChI=1S/C30H26FN3S/c1-21-7-5-11-24(19-21)28-29(35-30(34-28)23-12-14-26(31)15-13-23)25-16-18-33-27(20-25)32-17-6-10-22-8-3-2-4-9-22/h2-5,7-9,11-16,18-20H,6,10,17H2,1H3,(H,32,33)
InChI Key:
ZHDFEJICOOMGKN-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)c1nc(sc1c1ccnc(c1)NCCCc1ccccc1)c1ccc(cc1)F
Properties
Complexity:
621
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
479.183g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
479.617g/mol
Monoisotopic Mass:
479.183g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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