Haymine
TL;DR: Haymine (CAS 79861-91-9) is a chemical compound with molecular formula C30H39Cl2N3O5 and molecular weight 591.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(4-chlorophenoxy)-4-oxobut-2-enoic acid;N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride
Also Known As: Haymine, Novafed A syrup, Chlorpheniramine mixture with ephedrine, Chlorpheniramine, ephedrine drug combination, (Z)-4-(4-chlorophenoxy)-4-oxobut-2-enoic acid;N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride
| Molecular Formula | C30H39Cl2N3O5 |
|---|---|
| Molecular Weight | 591.23 g/mol |
| LogP | 5.2117 |
| Topological Polar Surface Area | 111.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 591.2267 |
| Heavy Atoms | 40 |
| Complexity | 1115.2076 |
Chemical Identifiers
| CAS Number | 79861-91-9 |
|---|---|
| SMILES | C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.CN(C)CCCC1=CC=CC=N1.C1=CC(=CC=C1OC(=O)/C=C\C(=O)O)Cl.Cl |
Product Overview
Haymine (CAS 79861-91-9), with molecular formula C30H39Cl2N3O5 and molecular weight 591.23 g/mol. IUPAC: (Z)-4-(4-chlorophenoxy)-4-oxobut-2-enoic acid;N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;(1R,2S)-2-(methylamino)-1-phenylpropan-1-ol;hydrochloride.
Chemical Property Profile of Haymine
Property Insights of Haymine
The XLogP value of 5.2117 indicates that Haymine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.99 Ų falls within the moderate polarity range, balancing permeability and solubility for Haymine. Following Lipinski's Rule of Five, Haymine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Haymine?
The CAS number of Haymine is 79861-91-9.
What is the molecular formula of Haymine?
The molecular formula of Haymine is C30H39Cl2N3O5.
What is the molecular weight of Haymine?
The molecular weight of Haymine is 591.23 g/mol.
Where can I buy Haymine?
You can request a quote for Haymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Haymine?
Yes, KEHONG BIO provides custom synthesis services for Haymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.