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740873-06-7

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Basic Information
CAS No.: 740873-06-7
Name: N-[3-[4-[4-[(Cyclohexylmethylsulfonyl)amino]butyl]piperazin-1-yl]phenyl]acetamide
Article Data: 2
Molecular Structure:
Molecular Structure of 740873-06-7 (N-[3-[4-[4-[(Cyclohexylmethylsulfonyl)amino]butyl]piperazin-1-yl]phenyl]acetamide)
Formula: C23H38N4O3S
Molecular Weight: 450.646
Synonyms: N-[3-[4-[4-[(Cyclohexylmethylsulfonyl)amino]butyl]piperazin-1-yl]phenyl]acetamide
Density: 1.169
PSA: 93.62000
LogP: 5.17100
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Chemistry

Molecule structure of Naluzotan (CAS NO.740873-06-7):

IUPAC Name: N-[3-[4-[4-(Cyclohexylmethylsulfonylamino)butyl]piperazin-1-yl]phenyl]acetamide
Molecular Weight: 450.63782 [g/mol]
Molecular Formula: C23H38N4O3S 
Density 1.169 g/cm3
XLogP3-AA: 3.2
H-Bond Donor: 2
H-Bond Acceptor: 6
Rotatable Bond Count: 10
Tautomer Count: 2
Exact Mass: 450.266462
MonoIsotopic Mass: 450.266462
Topological Polar Surface Area: 81.8
Heavy Atom Count: 31
Complexity: 638
Covalently-Bonded Unit Count: 1
Canonical 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
Classification Codeof Naluzotan (CAS NO.740873-06-7): Treatment of psychiatric disorders

Specification

 Naluzotan (CAS NO.740873-06-7) is also named as N-(3-(4-(4-Cyclohexylmethanesulfonylaminobutyl)piperazin-1-yl)phenyl)acetamide ; Naluzotan [USAN] ; N-(3-(4-(4-(((cyclohexylmethyl)sulfonyl)amino)butyl)piperazin-1-yl)phenyl)acetamide ; Naluzotan ; Acetamide, N-(3-(4-(4-(((cyclohexylmethyl)sulfonyl)amino)butyl)-1-piperazinyl)phenyl)- .