5- (2-Bromophenyl) thiazol-2-amine

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CAS Number

1378873-73-4

MDL Number

MFCD08276202

Smiles

N1c (sc (c1) c1ccccc1Br) N

Chemical Information

5-(2-Bromophenyl)thiazol-2-amine

CAS Number	1378873-73-4
PubChem CID	53416450
IUPAC Name	5-(2-bromophenyl)-1,3-thiazol-2-amine
Molecular Formula	C9H7BrN2S
Molecular Weight	255.14
XLogP	3
Topological Polar Surface Area	67.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	179

SMILES

C1=CC=C(C(=C1)C2=CN=C(S2)N)Br

InChI

InChI=1S/C9H7BrN2S/c10-7-4-2-1-3-6(7)8-5-12-9(11)13-8/h1-5H,(H2,11,12)

InChIKey

QKJACIDHYIWDOZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1378873-73-4

CID: 53416450

Formula: C9H7BrN2S

MW: 255.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	255.14
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	253.95133
Monoisotopic Mass	253.95133
Topological Polar Surface Area	67.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1077775	5- (3-Bromophenyl) thiazol-2-amine
OR1047353-01	5- (4-Bromophenyl) thiazol-2-amine
OR1089473-01	5- (5- (Benzyloxy) -2-bromophenyl) thiazol-2-amine
OR1089377-01	5- (2- (Benzyloxy) -5-bromophenyl) thiazol-2-amine
OR1089721	5- (2- (Benzyloxy) -3-bromophenyl) thiazol-2-amine
OR1089196-01	5- (4- (Benzyloxy) -3-bromophenyl) thiazol-2-amine
OR1073521-01	N- (4-Bromophenyl) benzo[d]thiazol-2-amine
OR1045254-01	5- (Methoxymethyl) thiazol-2-amine
OR311065	4- (3-Bromophenyl) -1,3-thiazol-2-amine
PC421096-01	2- (Trifluoromethyl) thiazol-5-amine

Catalog	Name
FB169202-01	4- (2-Bromophenyl) -1,3-thiazol-2-amine
VTB03308-01	4-[ (2-Bromophenyl) methyl]-1,3-thiazol-2-amine
FB112294-01	4- (3-Bromophenyl) -1,3-thiazol-2-amine
YCA04060-01	5- (4-Bromophenyl) -1,3-thiazol-2-amine
FMC16242-01	2- (4-Bromophenyl) -1,3-thiazol-4-amine
sc-348610	4-[ (4-bromophenyl) methyl]-1,3-thiazol-2-amine
CNA06246-01	5-[ (4-bromophenyl) methyl]-1,3-thiazol-2-amine
YLB73716-01	5-[ (3-Bromophenyl) methyl]-1,3-thiazol-2-amine
ZAC67490-01	4- (3-Bromophenyl) -N- (2-methoxyethyl) -1,3-thiazol-2-amine
sc-347950	4- (4-bromophenyl) -N- (2-phenylethyl) -1,3-thiazol-2-amine