CK1-IN-3

CAT: 0607-BA3748-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0607-BA3748-5Size:5 mg

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

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CAS Number

349438-74-0

Form

A solid

Molecular Formula

C17H16N2O3S

Molecular Weight

328.39

Shipping Conditions

Blue ice

Storage Conditions

-20°C, protect from light.

Chemical Information

N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)acetamide

CAS Number	349438-74-0
PubChem CID	670752
IUPAC Name	N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)acetamide
Molecular Formula	C17H16N2O3S
Molecular Weight	328.4
XLogP	3.4
Topological Polar Surface Area	88.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	23
Formal Charge	0
Complexity	409

SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CC=CC=C3OC

InChI

InChI=1S/C17H16N2O3S/c1-21-12-7-8-13-15(10-12)23-17(18-13)19-16(20)9-11-5-3-4-6-14(11)22-2/h3-8,10H,9H2,1-2H3,(H,18,19,20)

InChIKey

HFBLBLSJZDGKCC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 349438-74-0

CID: 670752

Formula: C17H16N2O3S

MW: 328.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	328.4
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	328.08816355
Monoisotopic Mass	328.08816355
Topological Polar Surface Area	88.7 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	409
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