SR 16584

CAT: 0926-AWB15386-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-AWB15386-01Size:25 mg

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

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CAS Number

1150153-86-8

MDL Number

MFCD22683823

Smiles

CN1C2CCCC1CC (C2) N3C (=O) CC4=CC=CC=C43

Molecular Formula

C17H22N2O

Molecular Weight

270.37 g/mol

Controlled

Yes

Chemical Information

CID 49840264

CAS Number	1150153-86-8
PubChem CID	49840264
IUPAC Name	1-[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]-3H-indol-2-one
Molecular Formula	C17H22N2O
Molecular Weight	270.37
XLogP	2.5
Topological Polar Surface Area	23.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	20
Formal Charge	0
Complexity	382

SMILES

CN1[C@@H]2CCC[C@H]1CC(C2)N3C(=O)CC4=CC=CC=C43

InChI

InChI=1S/C17H22N2O/c1-18-13-6-4-7-14(18)11-15(10-13)19-16-8-3-2-5-12(16)9-17(19)20/h2-3,5,8,13-15H,4,6-7,9-11H2,1H3/t13-,14+,15?

InChIKey

GIDZCNCCCWFCIN-YIONKMFJSA-N

Chemical Structure

2D Structure

CAS: 1150153-86-8

CID: 49840264

Formula: C17H22N2O

MW: 270.37

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	270.37
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	270.173213330
Monoisotopic Mass	270.173213330
Topological Polar Surface Area	23.6 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	382
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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
MBS5757851	SR 16584