FAS-IN-1 2mg

CAT: 0628-A21637-2Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0628-A21637-2Size:2 mg

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CAS Number

1375105-96-6

Chemical Information

Fas-IN-1

CAS Number	1375105-96-6
PubChem CID	69085357
IUPAC Name	4-cyclopropyl-9-(4-quinolin-7-ylphenyl)sulfonyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
Molecular Formula	C26H27N3O4S
Molecular Weight	477.6
XLogP	3
Topological Polar Surface Area	88.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	34
Formal Charge	0
Complexity	854

SMILES

C1CC1N2CC3(CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C5=CC6=C(C=CC=N6)C=C5)OCC2=O

InChI

InChI=1S/C26H27N3O4S/c30-25-17-33-26(18-29(25)22-7-8-22)11-14-28(15-12-26)34(31,32)23-9-5-19(6-10-23)21-4-3-20-2-1-13-27-24(20)16-21/h1-6,9-10,13,16,22H,7-8,11-12,14-15,17-18H2

InChIKey

OGGOWHOQMIINAZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1375105-96-6

CID: 69085357

Formula: C26H27N3O4S

MW: 477.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	477.6
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	477.17222752
Monoisotopic Mass	477.17222752
Topological Polar Surface Area	88.2 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	854
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

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MBS3846064-01	FAS-IN-1
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F0019-60B-01	Fas (CD95, APO-1)
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sc-19681	FAS-L (NOK-1)

FAS-IN-1 2mg

Chemical Information

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