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81512-62-1 | 2-Thiazolamine, N-[(4-chlorophenyl)methylene]-4-(4-methylphenyl)-
CAS No: 81512-62-1 Catalog No: AG005K9H MDL No:
Product Description
Catalog Number:
AG005K9H
Chemical Name:
2-Thiazolamine, N-[(4-chlorophenyl)methylene]-4-(4-methylphenyl)-
CAS Number:
81512-62-1
Molecular Formula:
C17H13ClN2S
Molecular Weight:
312.8165
IUPAC Name:
1-(4-chlorophenyl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]methanimine
InChI:
InChI=1S/C17H13ClN2S/c1-12-2-6-14(7-3-12)16-11-21-17(20-16)19-10-13-4-8-15(18)9-5-13/h2-11H,1H3
InChI Key:
BMCVOMSEEYNUSL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1csc(n1)N=Cc1ccc(cc1)Cl
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.815g/mol
Monoisotopic Mass:
312.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.2
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