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CAT: 0607-BA6905-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0607-BA6905-25Size:25 mg

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

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CAS Number

326921-25-9

Form

A solid

Molecular Formula

C18H14ClN3O2S

Molecular Weight

371.84

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

4-chloro-N'-(2-quinolin-2-ylsulfanylacetyl)benzohydrazide

CAS Number	326921-25-9
PubChem CID	3115384
IUPAC Name	4-chloro-N'-(2-quinolin-2-ylsulfanylacetyl)benzohydrazide
Molecular Formula	C18H14ClN3O2S
Molecular Weight	371.8
XLogP	4.2
Topological Polar Surface Area	96.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	471

SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)NNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3O2S/c19-14-8-5-13(6-9-14)18(24)22-21-16(23)11-25-17-10-7-12-3-1-2-4-15(12)20-17/h1-10H,11H2,(H,21,23)(H,22,24)

InChIKey

BWTKIGGLLXUFSV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 326921-25-9

CID: 3115384

Formula: C18H14ClN3O2S

MW: 371.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	371.8
XLogP3	4.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	371.0495256
Monoisotopic Mass	371.0495256
Topological Polar Surface Area	96.4 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	471
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
HY-134559-01	TKIM