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Disobutamide

HCID 68566
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
68284-69-5
Standard SMILES
CC(C)N(CCC(CCN1CCCCC1)(C(N)=O)c1ccccc1Cl)C(C)C
InChIKey
YKFWMDHZMQLWBO-UHFFFAOYSA-N
Molecular formula
C23H38ClN3O
Average molar mass
408 g/mol
Monoisotopic mass
407.2703405

Overview

Disobutamide is a member of acetamides.

Names & identifiers

Preferred name
Disobutamide
IUPAC
2-(2-chlorophenyl)-2-[2-[di(propan-2-yl)amino]ethyl]-4-piperidin-1-ylbutanamide
English name
Disobutamide
Molecular formula
C23H38ClN3O
Molecular weight
408.026

Names & synonyms

Disobutamide68284-69-5DisobutamidaDisobutamidumSC-318284IZG3M7XVPalpha-(2-bis(1-methylethyl)amino)-alpha-(2-chlorophenyl)-1-piperidinebutanamideRefChem:9204862-(2-chlorophenyl)-2-[2-[di(propan-2-yl)amino]ethyl]-4-piperidin-1-ylbutanamide1-Piperidinebutanamide, alpha-(2-(bis(1-methylethyl)amino)ethyl)-alpha-(2-chlorophenyl)-alpha-(o-Chlorophenyl)-alpha-(2-(diisopropylamino)ethyl)-1-piperidinebutyramideUNII-4IZG3M7XVP
Show more names
α-(2-Chlorophenyl)-α-[2-(diisopropylamino)ethyl]-1-piperidinebutyramide2-(2-chlorophenyl)-4-(diisopropylamino)-2-[2-(1-piperidinyl)ethyl]butanamide1-Piperidinebutanamide, α-[2-[bis(1-methylethyl)amino]ethyl]-α-(2-chlorophenyl)-
Disobutamide [USAN:INN]Disobutamidum [INN-Latin]Disobutamida [INN-Spanish]alpha-(O-Chlorophenyl)-alpha-[2-(diisopropylamino)ethyl]-1-piperidinebutyramideSC 31828Disobutamide (USAN/INN)DISOBUTAMIDE [INN]DISOBUTAMIDE [USAN]

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
49.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
28
Formal charge
0
Complexity
470

Experimental & physicochemical properties

LogP4.78

Physicochemical properties

FDA UNII
4 IZG3M7XVP · 4IZG3M7XVP

Chemistry & industry

Applications

UsesCardiac depressant (anti-arrhythmic).

Suppliers3 total

上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]

Additional notes

DefinitionChEBI: Disobutamide is a member of acetamides.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
68284-69-5
PubChem CID
68566
DTXSID
DTXSID80867557
ChEMBL
CHEMBL276177
ChEBI
CHEBI:188656
UNII
4IZG3M7XVP
Nikkaji
J18.780A