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116365-95-8 | 2-Thiazolamine, 4-(4-chlorophenyl)-N-[(4-nitrophenyl)methylene]-
CAS No: 116365-95-8 Catalog No: AG000CB6 MDL No:
Product Description
Catalog Number:
AG000CB6
Chemical Name:
2-Thiazolamine, 4-(4-chlorophenyl)-N-[(4-nitrophenyl)methylene]-
CAS Number:
116365-95-8
Molecular Formula:
C16H10ClN3O2S
Molecular Weight:
343.7875
IUPAC Name:
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-(4-nitrophenyl)methanimine
InChI:
InChI=1S/C16H10ClN3O2S/c17-13-5-3-12(4-6-13)15-10-23-16(19-15)18-9-11-1-7-14(8-2-11)20(21)22/h1-10H
InChI Key:
JSSFOHRITPEOTQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1csc(n1)N=Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.018g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.785g/mol
Monoisotopic Mass:
343.018g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5
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