RefChem:348603
TL;DR: RefChem:348603 (CAS 3458-62-6) is a chemical compound with molecular formula C16H20Cl2N4O2S and molecular weight 402.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-1-[2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine;dihydrochloride
Also Known As: Imidazo(1,2-a)pyrimidine, 3-(dimethylaminomethyl)-2-(p-methylsulfonylphenyl)-, dihydrochloride, 3-(Dimethylaminomethyl)-2-(p-methylsulfonylphenyl)imidazo(1,2-a)pyrimidine dihydrochloride, N,N-dimethyl-1-[2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyri, N,N-Dimethyl-1-{2-[4-(methylsulfonyl)phenyl]imidazo[1,2-a]pyrimidin-3-yl}methanamine dihydrochloride, 1-{2-[4-(Methanesulfonyl)phenyl]imidazo[1,2-a]pyrimidin-3-yl}-N,N-dimethylmethanamine--hydrogen chloride (1/2)
| Molecular Formula | C16H20Cl2N4O2S |
|---|---|
| Molecular Weight | 402.07 g/mol |
| LogP | 2.705 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.0684 |
| Heavy Atoms | 25 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 3458-62-6 |
|---|---|
| SMILES | CN(C)CC1=C(N=C2N1C=CC=N2)C3=CC=C(C=C3)S(=O)(=O)C.Cl.Cl |
| InChIKey | OZDUUMVWWVPXRG-UHFFFAOYSA-N |
Product Overview
RefChem:348603 (CAS 3458-62-6), with molecular formula C16H20Cl2N4O2S and molecular weight 402.07 g/mol. IUPAC: N,N-dimethyl-1-[2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine;dihydrochloride.
Chemical Property Profile of RefChem:348603
Property Insights of RefChem:348603
The XLogP value of 2.705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:348603. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:348603. Following Lipinski's Rule of Five, RefChem:348603 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 RefChem:348603?
The CAS number of RefChem:348603 is 3458-62-6.
What is the molecular formula of RefChem:348603?
The molecular formula of RefChem:348603 is C16H20Cl2N4O2S.
What is the molecular weight of RefChem:348603?
The molecular weight of RefChem:348603 is 402.07 g/mol.
Where can I buy RefChem:348603?
You can request a quote for RefChem:348603 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:348603?
Yes, KEHONG BIO provides custom synthesis services for RefChem:348603 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.