Imet 3146
TL;DR: Imet 3146 (CAS 32021-40-2) is a chemical compound with molecular formula C20H22Cl2N4O2 and molecular weight 420.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[5-[bis(2-chloroethyl)amino]-1-phenylbenzimidazol-2-yl]propanoic acid
Also Known As: Imet 3146, Zimet 3164, ZIMET 31/64, IMET 3146, (+-)-isomer, 5-25-17-00018 (Beilstein Handbook Reference)
| Molecular Formula | C20H22Cl2N4O2 |
|---|---|
| Molecular Weight | 420.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 420.11197 |
| Heavy Atoms | 28 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 32021-40-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(CCCl)CCCl)N=C2CC(C(=O)O)N |
| InChIKey | NMSSNIMMZNQSNV-UHFFFAOYSA-N |
Product Overview
Imet 3146 (CAS 32021-40-2), with molecular formula C20H22Cl2N4O2 and molecular weight 420.11 g/mol. IUPAC: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1-phenylbenzimidazol-2-yl]propanoic acid.
Chemical Property Profile of Imet 3146
Property Insights of Imet 3146
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imet 3146. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Imet 3146. Following Lipinski's Rule of Five, Imet 3146 has 2 hydrogen bond donor(s) and 5 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 Imet 3146?
The CAS number of Imet 3146 is 32021-40-2.
What is the molecular formula of Imet 3146?
The molecular formula of Imet 3146 is C20H22Cl2N4O2.
What is the molecular weight of Imet 3146?
The molecular weight of Imet 3146 is 420.11 g/mol.
Where can I buy Imet 3146?
You can request a quote for Imet 3146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imet 3146?
Yes, KEHONG BIO provides custom synthesis services for Imet 3146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.