![2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide structure](/static/products/460/460709-68-6.png)
2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide
TL;DR: 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide (CAS 460709-68-6) is a chemical compound with molecular formula C18H16BrCl2N3O and molecular weight 438.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-2-(2-imino-3-prop-2-enylbenzimidazol-1-yl)ethanone;hydrobromide
Also Known As: 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide, 1-(3,4-dichlorophenyl)-2-(2-imino-3-prop-2-enyl-benzoimidazol-1-yl)ethanone Hydrobromide, 1-(3,4-dichlorophenyl)-2-(2-imino-3-prop-2-enylbenzimidazol-1-yl)ethanone hydrobromide
| Molecular Formula | C18H16BrCl2N3O |
|---|---|
| Molecular Weight | 438.99 g/mol |
| LogP | 4.87587 |
| Topological Polar Surface Area | 50.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.98538 |
| Heavy Atoms | 25 |
| Complexity | 1007.2141 |
Chemical Identifiers
| CAS Number | 460709-68-6 |
|---|---|
| SMILES | C=CCN1C2=CC=CC=C2N(C1=N)CC(=O)C3=CC(=C(C=C3)Cl)Cl.Br |
Product Overview
2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide (CAS 460709-68-6), with molecular formula C18H16BrCl2N3O and molecular weight 438.99 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-2-(2-imino-3-prop-2-enylbenzimidazol-1-yl)ethanone;hydrobromide.
Chemical Property Profile of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide
Property Insights of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide
The XLogP value of 4.87587 indicates that 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.78 Ų, 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide?
The CAS number of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide is 460709-68-6.
What is the molecular formula of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide?
The molecular formula of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide is C18H16BrCl2N3O.
What is the molecular weight of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide?
The molecular weight of 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide is 438.99 g/mol.
Where can I buy 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide?
You can request a quote for 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-allyl-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(3,4-dichlorophenyl)ethanone hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.