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Home > Pyridines > 381171-69-3
381171-69-3 | N,4-diphenyl-3-(pyridin-3-ylmethyl)-2,3-dihydro-1,3-thiazol-2-imine
CAS No: 381171-69-3 Catalog No: AG019K4V MDL No:MFCD08444404
Product Description
Catalog Number:
AG019K4V
Chemical Name:
N,4-diphenyl-3-(pyridin-3-ylmethyl)-2,3-dihydro-1,3-thiazol-2-imine
CAS Number:
381171-69-3
Molecular Formula:
C21H17N3S
Molecular Weight:
343.4448
MDL Number:
MFCD08444404
IUPAC Name:
N,4-diphenyl-3-(pyridin-3-ylmethyl)-1,3-thiazol-2-imine
InChI:
InChI=1S/C21H17N3S/c1-3-9-18(10-4-1)20-16-25-21(23-19-11-5-2-6-12-19)24(20)15-17-8-7-13-22-14-17/h1-14,16H,15H2
InChI Key:
SPGWDSRXEQHWPK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N=c1scc(n1Cc1cccnc1)c1ccccc1
Properties
Complexity:
489
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.114g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.448g/mol
Monoisotopic Mass:
343.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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