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84304-49-4 | 1,3,4-Thiadiazol-2-amine, 5-(4-chlorophenyl)-N-(phenylmethylene)-
CAS No: 84304-49-4 Catalog No: AG004XYF MDL No:
Product Description
Catalog Number:
AG004XYF
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-(4-chlorophenyl)-N-(phenylmethylene)-
CAS Number:
84304-49-4
Molecular Formula:
C15H10ClN3S
Molecular Weight:
299.7780
IUPAC Name:
N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1-phenylmethanimine
InChI:
InChI=1S/C15H10ClN3S/c16-13-8-6-12(7-9-13)14-18-19-15(20-14)17-10-11-4-2-1-3-5-11/h1-10H
InChI Key:
YKXFZGUIICPGCN-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nnc(s1)N=Cc1ccccc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.028g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.776g/mol
Monoisotopic Mass:
299.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.3
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