Nhe3-IN-1
TL;DR: Nhe3-IN-1 (CAS 632355-68-1) is a chemical compound with molecular formula C12H10ClN3S and molecular weight 263.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-4-methylthiophen-3-yl)-1H-benzimidazol-2-amine
Also Known As: NHE3-IN-1, NHE3-IN-1?, N-(2-Chloro-4-methylthiophen-3-yl)-1H-benzo[d]imidazol-2-amine, N-(2-chloro-4-methylthiophen-3-yl)-1H-benzimidazol-2-amine, N-(2-chloro-4-methyl-3-thienyl)-1H-benzimidazol-2-amine
| Molecular Formula | C12H10ClN3S |
|---|---|
| Molecular Weight | 263.03 g/mol |
| LogP | 4.32982 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.02838 |
| Heavy Atoms | 17 |
| Complexity | 618.7541 |
Chemical Identifiers
| CAS Number | 632355-68-1 |
|---|---|
| SMILES | CC1=CSC(=C1NC2=NC3=CC=CC=C3N2)Cl |
Product Overview
Nhe3-IN-1 (CAS 632355-68-1), with molecular formula C12H10ClN3S and molecular weight 263.03 g/mol. IUPAC: N-(2-chloro-4-methylthiophen-3-yl)-1H-benzimidazol-2-amine.
Chemical Property Profile of Nhe3-IN-1
Property Insights of Nhe3-IN-1
The XLogP value of 4.32982 indicates that Nhe3-IN-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.71 Ų, Nhe3-IN-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nhe3-IN-1 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
Frequently Asked Questions
What is the CAS number of Nhe3-IN-1?
The CAS number of Nhe3-IN-1 is 632355-68-1.
What is the molecular formula of Nhe3-IN-1?
The molecular formula of Nhe3-IN-1 is C12H10ClN3S.
What is the molecular weight of Nhe3-IN-1?
The molecular weight of Nhe3-IN-1 is 263.03 g/mol.
Where can I buy Nhe3-IN-1?
You can request a quote for Nhe3-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nhe3-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Nhe3-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.