氯胍
TL;DR: 氯胍 (CAS 500-92-5) is a chemical compound with molecular formula C11H16ClN5 and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯胍
1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine
Also Known As: proguanil, Chloroguanide, Bigumal, Chlorguanid, Chlorguanide
| Molecular Formula | C11H16ClN5 |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.10942 |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
| Melting Point | 129 °C |
| Solubility | 2.86e-01 g/L |
Chemical Identifiers
| CAS Number | 500-92-5 |
|---|---|
| SMILES | CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl |
| InChIKey | SSOLNOMRVKKSON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯胍 (CAS 500-92-5), with molecular formula C11H16ClN5 and molecular weight 253.11 g/mol. IUPAC: 1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine.
Chemical Property Profile of 氯胍
Property Insights of 氯胍
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯胍. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 氯胍. Following Lipinski's Rule of Five, 氯胍 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
Frequently Asked Questions
What is the CAS number of 氯胍?
The CAS number of 氯胍 is 500-92-5.
What is the molecular formula of 氯胍?
The molecular formula of 氯胍 is C11H16ClN5.
What is the molecular weight of 氯胍?
The molecular weight of 氯胍 is 253.11 g/mol.
Where can I buy 氯胍?
You can request a quote for 氯胍 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯胍?
Yes, KEHONG BIO provides custom synthesis services for 氯胍 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.