KCC-07

CAT: 0127-BUP12828-03Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP12828-03Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

315702-75-1

Purity

=98%

Smiles

OC1=CC=CC(NC2=NC(=CS2)C2=NC=CC=C2)=C1

Chemical Information

3-[(4-Pyridin-2-yl-1,3-thiazol-2-yl)amino]phenol

CAS Number	315702-75-1
PubChem CID	704347
IUPAC Name	3-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]phenol
Molecular Formula	C14H11N3OS
Molecular Weight	269.32
XLogP	3.1
Topological Polar Surface Area	86.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	19
Formal Charge	0
Complexity	292

SMILES

C1=CC=NC(=C1)C2=CSC(=N2)NC3=CC(=CC=C3)O

InChI

InChI=1S/C14H11N3OS/c18-11-5-3-4-10(8-11)16-14-17-13(9-19-14)12-6-1-2-7-15-12/h1-9,18H,(H,16,17)

InChIKey

GIGNWEDIMLUWCT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 315702-75-1

CID: 704347

Formula: C14H11N3OS

MW: 269.32

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	269.32
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	269.06228316
Monoisotopic Mass	269.06228316
Topological Polar Surface Area	86.3 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	292
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
BUP09127-01	SH5-07
BUP14746	Urease Inhibitor 07
BAL6543	Influenza A H1N1 (A/California/07/2009) Hemagglutinin / HA Protein (C-His Tag), 1 pack = 100 µg
BAL6544	Influenza A H1N1 (A/California/07/2009) Nucleoprotein / NP Protein (C-His Tag), 1 pack = 100 µg
BUP08984-01	(+) -KCC2 blocker 1