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HP1328

CAT: 0013-GTR19186767-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19186767-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
HP1328
CAS Number
2245074-20-6
Field of Research
Cardiovascular Research, Signal Transduction
Smiles
N (CC1=CC (OC) =C (OCCO) C=C1) C=2C=C3C (N (C=N3) C4=CC=CC=C4) =CC2
Molecular Formula
C23H23N3O3
Molecular Weight
389.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-[2-Methoxy-4-[[(1-phenylbenzimidazol-5-yl)amino]methyl]phenoxy]ethanol
CAS Number2245074-20-6
PubChem CID162679329
IUPAC Name2-[2-methoxy-4-[[(1-phenylbenzimidazol-5-yl)amino]methyl]phenoxy]ethanol
Molecular FormulaC23H23N3O3
Molecular Weight389.4
XLogP3.8
Topological Polar Surface Area68.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity488
SMILES
COC1=C(C=CC(=C1)CNC2=CC3=C(C=C2)N(C=N3)C4=CC=CC=C4)OCCO
InChI
InChI=1S/C23H23N3O3/c1-28-23-13-17(7-10-22(23)29-12-11-27)15-24-18-8-9-21-20(14-18)25-16-26(21)19-5-3-2-4-6-19/h2-10,13-14,16,24,27H,11-12,15H2,1H3
InChIKey
FNNZOQPZURDRII-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[2-Methoxy-4-[[(1-phenylbenzimidazol-5-yl)amino]methyl]phenoxy]ethanol
CAS: 2245074-20-6
CID: 162679329
Formula: C23H23N3O3
MW: 389.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight389.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass389.17394160
Monoisotopic Mass389.17394160
Topological Polar Surface Area68.5 Ų
Heavy Atom Count29
Formal Charge0
Complexity488
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

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CatalogName
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