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1177741-83-1 | Phenol, 4-[[4-(4-chlorophenyl)-2-thiazolyl]amino]-, hydrochloride (1:1)
CAS No: 1177741-83-1 Catalog No: AG000HSY MDL No:
Product Description
Catalog Number:
AG000HSY
Chemical Name:
Phenol, 4-[[4-(4-chlorophenyl)-2-thiazolyl]amino]-, hydrochloride (1:1)
CAS Number:
1177741-83-1
Molecular Formula:
C15H12Cl2N2OS
Molecular Weight:
339.2396
IUPAC Name:
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenol;hydrochloride
InChI:
InChI=1S/C15H11ClN2OS.ClH/c16-11-3-1-10(2-4-11)14-9-20-15(18-14)17-12-5-7-13(19)8-6-12;/h1-9,19H,(H,17,18);1H
InChI Key:
ZDRVLAOYDGQLFI-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Nc1scc(n1)c1ccc(cc1)Cl.Cl
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.005g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
339.234g/mol
Monoisotopic Mass:
338.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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