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Naluzotan

CAT: 0607-BA5067-1Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0607-BA5067-1Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
740873-06-7
Form
A solid
Molecular Formula
C23H38N4O3S
Molecular Weight
450.64
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Naluzotan

an antidepressant and anti-anxiety agent; structure in first source

CAS Number740873-06-7
PubChem CID11430856
IUPAC NameN-[3-[4-[4-(cyclohexylmethylsulfonylamino)butyl]piperazin-1-yl]phenyl]acetamide
Molecular FormulaC23H38N4O3S
Molecular Weight450.6
XLogP3.2
Topological Polar Surface Area90.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count31
Formal Charge0
Complexity638
SMILES
CC(=O)NC1=CC(=CC=C1)N2CCN(CC2)CCCCNS(=O)(=O)CC3CCCCC3
InChI
InChI=1S/C23H38N4O3S/c1-20(28)25-22-10-7-11-23(18-22)27-16-14-26(15-17-27)13-6-5-12-24-31(29,30)19-21-8-3-2-4-9-21/h7,10-11,18,21,24H,2-6,8-9,12-17,19H2,1H3,(H,25,28)
InChIKey
SPWZXWDPAWDKQE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Naluzotan
CAS: 740873-06-7
CID: 11430856
Formula: C23H38N4O3S
MW: 450.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight450.6
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass450.26646226
Monoisotopic Mass450.26646226
Topological Polar Surface Area90.1 Ų
Heavy Atom Count31
Formal Charge0
Complexity638
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
QEB87306Naluzotan
A22028-5Naluzotan 5mg
HY-14848A-01Naluzotan (hydrochloride)
T68113-01Naluzotan hydrochloride
A22028-1Naluzotan 1mg
A22028-10Naluzotan 10mg

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