VPC-14228

CAT: 0127-BUP03500-06Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP03500-06Size:100 mg

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

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CAS Number

19983-28-9

Synonyms

VPC 14228, VPC14228

Purity

=98%

Smiles

C1CN(CCO1)C1=NC(=CS1)C1=CC=CC=C1

Chemical Information

4-(4-Phenyl-1,3-thiazol-2-yl)morpholine

CAS Number	19983-28-9
PubChem CID	727584
IUPAC Name	4-(4-phenyl-1,3-thiazol-2-yl)morpholine
Molecular Formula	C13H14N2OS
Molecular Weight	246.33
XLogP	2.7
Topological Polar Surface Area	53.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	240

SMILES

C1COCCN1C2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C13H14N2OS/c1-2-4-11(5-3-1)12-10-17-13(14-12)15-6-8-16-9-7-15/h1-5,10H,6-9H2

InChIKey

MRNNJVNMXOZEQC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19983-28-9

CID: 727584

Formula: C13H14N2OS

MW: 246.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	246.33
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	246.08268425
Monoisotopic Mass	246.08268425
Topological Polar Surface Area	53.6 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	240
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