alpha,N(alpha)-dimethylhistamine
TL;DR: alpha,N(alpha)-dimethylhistamine (CAS 76721-87-4) is a chemical compound with molecular formula C7H13N3 and molecular weight 139.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-(1H-imidazol-5-yl)-N-methylpropan-2-amine
Also Known As: alpha,N(alpha)-Dimethylhistamine, 1-(1H-imidazol-5-yl)-N-methylpropan-2-amine, (2R)-1-(1H-imidazol-5-yl)-N-methylpropan-2-amine, (2R)-1-(3H-imidazol-4-yl)-N-methylpropan-2-amine, RefChem:111025
| Molecular Formula | C7H13N3 |
|---|---|
| Molecular Weight | 139.11 g/mol |
| LogP | 0.5601 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 139.11095 |
| Heavy Atoms | 10 |
| Complexity | 168.98671 |
Chemical Identifiers
| CAS Number | 76721-87-4 |
|---|---|
| SMILES | C[C@H](CC1=CN=CN1)NC |
Product Overview
alpha,N(alpha)-dimethylhistamine (CAS 76721-87-4), with molecular formula C7H13N3 and molecular weight 139.11 g/mol. IUPAC: (2R)-1-(1H-imidazol-5-yl)-N-methylpropan-2-amine.
Chemical Property Profile of alpha,N(alpha)-dimethylhistamine
Property Insights of alpha,N(alpha)-dimethylhistamine
The XLogP value of 0.5601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha,N(alpha)-dimethylhistamine. With a topological polar surface area (TPSA) of 40.71 Ų, alpha,N(alpha)-dimethylhistamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha,N(alpha)-dimethylhistamine has 2 hydrogen bond donor(s) and 2 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 alpha,N(alpha)-dimethylhistamine?
The CAS number of alpha,N(alpha)-dimethylhistamine is 76721-87-4.
What is the molecular formula of alpha,N(alpha)-dimethylhistamine?
The molecular formula of alpha,N(alpha)-dimethylhistamine is C7H13N3.
What is the molecular weight of alpha,N(alpha)-dimethylhistamine?
The molecular weight of alpha,N(alpha)-dimethylhistamine is 139.11 g/mol.
Where can I buy alpha,N(alpha)-dimethylhistamine?
You can request a quote for alpha,N(alpha)-dimethylhistamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha,N(alpha)-dimethylhistamine?
Yes, KEHONG BIO provides custom synthesis services for alpha,N(alpha)-dimethylhistamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.