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1,3-Di-(4-imidazolino-2-methoxyphenoxy)propane

HCID 60323
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Basic information

CAS
109444-03-3
Standard SMILES
COc1cc(C2=NCCN2)ccc1OCCCOc1ccc(C2=NCCN2)cc1OC
InChIKey
LFHGPTOVDLGVSE-UHFFFAOYSA-N
Molecular formula
C23H28N4O4
Average molar mass
424.5 g/mol
Monoisotopic mass
424.21105539

Overview

structure given in first source

Names & identifiers

Preferred name
1,3-Di-(4-imidazolino-2-methoxyphenoxy)propane
IUPAC
2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxyphenoxy]propoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole
English name
1,3-Di-(4-imidazolino-2-methoxyphenoxy)propane
Molecular formula
C23H28N4O4
Molecular weight
424.49

Names & synonyms

109444-03-3DMP LACTATE1,3-Dimpp9JBO5F5LLM1,3-Di-(4-imidazolino-2-methoxyphenoxy)propaneRefChem:9068681,3-Bis(4-(imidazolin-2-yl)-2-methoxyphenoxy)propane129051-03-22-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxyphenoxy]propoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole1,3-Bis[4-(imidazolin-2-yl)-2-methoxyphenoxy]propaneUNII-9JBO5F5LLM1,3-Di-(4-imidazolino-2-methoxyphenoxy)propane lactate
Show more names
1H-Imidazole, 2,2'-[1,3-propanediylbis[oxy(3-methoxy-4,1-phenylene)]]bis[4,5-dihydro-
CHEMBL1161187SCHEMBL14599544DTXSID609111682,2'-(1,3-Propanediylbis(oxy(3-methoxy-4,1-phenylene)))bis(4,5-dihydro-1H-imidazole2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxy-phenoxy]propoxy]-3-methoxy-phenyl]-4,5-dihydro-11,3-DI(4-IMIDAZOLINO-2-METHOXYPHENOXY) PROPANEO,O'-BIS(4-(IMIDAZOLIN-2-YL)-(2-METHOXY)PHENYL)-1,3-PROPANEDIOL1H-Imidazole, 2,2'-(1,3-propanediylbis(oxy(3-methoxy-4,1-phenylene))bis(4,5-dihydro-

Database identifiers

CAS
109444-03-3、119014-74-3

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
85.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
31
Formal charge
0
Complexity
577

Physicochemical properties

FDA UNII
9 JBO5F5LLM · 9JBO5F5LLM

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
PubChem CID
60323
DTXSID
DTXSID60911168
ChEMBL
CHEMBL1161187
UNII
9JBO5F5LLM
Nikkaji
J412.375A