N1-(4-Chlorophenyl)-N5-isopropylbiguanide
TL;DR: N1-(4-Chlorophenyl)-N5-isopropylbiguanide (CAS 500-92-5) is a chemical compound with molecular formula C11H16ClN5 and molecular weight 253.10942 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine
Also Known As: proguanil, Chloroguanide, Bigumal, Chlorguanid, Chlorguanide
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H16ClN5 |
| Molecular Weight | 253.10942 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.10942 Da |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
| Melting Point | 129 °C |
| Solubility | 2.86e-01 g/L |
| SMILES | CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl |
| InChIKey | SSOLNOMRVKKSON-UHFFFAOYSA-N |
Product Description
Applications: N1-(4-Chlorophenyl)-N5-isopropylbiguanide is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N1-(4-Chlorophenyl)-N5-isopropylbiguanide (CAS 500-92-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
N1-(4-Chlorophenyl)-N5-isopropylbiguanide is a pharmaceutical intermediate identified by CAS number 500-92-5 and the molecular formula C11H16ClN5 and a molecular weight of 253.11 g/mol. Physically, the compound has a solubility: 2.86e-01 g/L. It is also known as proguanil and Chloroguanide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N1-(4-Chlorophenyl)-N5-isopropylbiguanide
Property Insights of N1-(4-Chlorophenyl)-N5-isopropylbiguanide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(4-Chlorophenyl)-N5-isopropylbiguanide. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(4-Chlorophenyl)-N5-isopropylbiguanide. Following Lipinski's Rule of Five, N1-(4-Chlorophenyl)-N5-isopropylbiguanide has 3 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
The CAS number of N1-(4-Chlorophenyl)-N5-isopropylbiguanide is 500-92-5.
What is the molecular formula of N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
The molecular formula of N1-(4-Chlorophenyl)-N5-isopropylbiguanide is C11H16ClN5.
What is the molecular weight of N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
The molecular weight of N1-(4-Chlorophenyl)-N5-isopropylbiguanide is 253.10942 g/mol.
What are the applications of N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
N1-(4-Chlorophenyl)-N5-isopropylbiguanide is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
You can request a quote for N1-(4-Chlorophenyl)-N5-isopropylbiguanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N1-(4-Chlorophenyl)-N5-isopropylbiguanide?
Yes, CoreyChem provides custom synthesis services for N1-(4-Chlorophenyl)-N5-isopropylbiguanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.