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1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- structure
Fine Chemical

1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-

TL;DR: 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- (CAS 1052533-55-7) is a chemical compound with molecular formula C20H24ClN3O3 and molecular weight 389.1506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(2-imino-3-prop-2-enylbenzimidazol-1-yl)-3-(2-methoxyphenoxy)propan-2-ol;hydrochloride

Also Known As: 1-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-3-(2-methoxyphenoxy)propan-2-ol hydrochloride, 1-(2-imino-3-prop-2-enylbenzimidazol-1-yl)-3-(2-methoxyphenoxy)propan-2-ol hydrochloride, 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-

CAS Number
1052533-55-7
Molecular Formula
C20H24ClN3O3
Molecular Weight
389.1506 g/mol
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Technical Specifications

Molecular FormulaC20H24ClN3O3
Molecular Weight389.1506 g/mol
XLogP2.97857
Topological Polar Surface Area (TPSA)69.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds8
Exact Mass389.1506 Da
Heavy Atoms27
Complexity487.0
SMILESCOC1=CC=CC=C1OCC(CN2C3=CC=CC=C3N(C2=N)CC=C)O.Cl
InChIKeyWPHHPIBKGFSCFA-UHFFFAOYSA-N

Chemical Property Profile of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-

XLogP
2.97857
TPSA (Topological Polar Surface Area)
69.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
27
Complexity
487.0
Exact Mass
389.1506
Monoisotopic Mass
389.1506
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-

The XLogP value of 2.97857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-. Following Lipinski's Rule of Five, 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-?

The CAS number of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- is 1052533-55-7.

What is the molecular formula of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-?

The molecular formula of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- is C20H24ClN3O3.

What is the molecular weight of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-?

The molecular weight of 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- is 389.1506 g/mol.

Where can I buy 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-?

You can request a quote for 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan-?

Yes, CoreyChem provides custom synthesis services for 1-(3-Allyl-2-imino-2,3-dihydro-benzoimidazol-1-yl)-3-(2-methoxy-phenoxy)-propan- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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