3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine structure

3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine

TL;DR: 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine (CAS 94266-27-0) is a chemical compound with molecular formula C9H7Cl2N5 and molecular weight 255.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2,4-dichloro-N-(diaminomethylideneamino)benzenecarboximidoyl cyanide

Also Known As: Lamotrigine Impurity 2, Lamotrigine Impurity 5, Lamotrigine Impurity 33, 3-[CYANO(2,4-DICHLOROPHENYL)METHYLENE]CARBAZAMIDINE, EINECS 304-433-9

CAS: 94266-27-0
Molecular Formula C9H7Cl2N5
Molecular Weight 255.01 g/mol
LogP 1.49448
Topological Polar Surface Area 100.55 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 255.00784
Heavy Atoms 16
Complexity 497.11108

Chemical Identifiers

CAS Number 94266-27-0
SMILES C1=CC(=C(C=C1Cl)Cl)C(=NN=C(N)N)C#N

Product Overview

3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine (CAS 94266-27-0), with molecular formula C9H7Cl2N5 and molecular weight 255.01 g/mol. IUPAC: 2,4-dichloro-N-(diaminomethylideneamino)benzenecarboximidoyl cyanide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine

XLogP
1.49448
TPSA (Topological Polar Surface Area)
100.55
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
16
Complexity
497.11108
Exact Mass
255.00784
Monoisotopic Mass
255.00784
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 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine

The XLogP value of 1.49448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine. The TPSA of 100.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine. Following Lipinski's Rule of Five, 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine?

The CAS number of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine is 94266-27-0.

What is the molecular formula of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine?

The molecular formula of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine is C9H7Cl2N5.

What is the molecular weight of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine?

The molecular weight of 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine is 255.01 g/mol.

Where can I buy 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine?

You can request a quote for 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine?

Yes, KEHONG BIO provides custom synthesis services for 3-[Cyano(2,4-dichlorophenyl)methylene]carbazamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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