GSK2200150A

CAT: 0607-BA1493-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA1493-50Size:50 mg

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

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CAS Number

1443138-53-1

Form

A solid

Molecular Formula

C20H23NO3S

Molecular Weight

357.47

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

1'-(2,3-Dihydro-1,4-benzodioxin-6-ylmethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]

CAS Number	1443138-53-1
PubChem CID	70689288
IUPAC Name	1'-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
Molecular Formula	C20H23NO3S
Molecular Weight	357.5
XLogP	2.9
Topological Polar Surface Area	59.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	25
Formal Charge	0
Complexity	468

SMILES

C1COC2(CCN(CC2)CC3=CC4=C(C=C3)OCCO4)C5=C1SC=C5

InChI

InChI=1S/C20H23NO3S/c1-2-17-18(23-11-10-22-17)13-15(1)14-21-7-5-20(6-8-21)16-4-12-25-19(16)3-9-24-20/h1-2,4,12-13H,3,5-11,14H2

InChIKey

NCRPMBWORFWNGT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1443138-53-1

CID: 70689288

Formula: C20H23NO3S

MW: 357.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	357.5
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	357.13986477
Monoisotopic Mass	357.13986477
Topological Polar Surface Area	59.2 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	468
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