Meproadifen mustard
TL;DR: Meproadifen mustard (CAS 105555-57-5) is a chemical compound with molecular formula C22H29Cl2NO2 and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloroethyl(methyl)amino]ethyl 2-[2-(1-phenylpropyl)phenyl]acetate;hydrochloride
Also Known As: Meproadifen mustard, o-fluorene-9-carboxamidobenzoic acid, 2-(Chloroethylmethylamino)ethyl-2,2-diphenylpentanoate hcl, 2-[2-chloroethyl(methyl)amino]ethyl 2,2-diphenylpentanoate;hydrochloride, 2-(chloroethylmethylamino)ethyl-2,2-diphenylpentanoate hydrochloride
| Molecular Formula | C22H29Cl2NO2 |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 4.9066 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 409.15753 |
| Heavy Atoms | 27 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 105555-57-5 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C2=CC=CC=C2CC(=O)OCCN(C)CCCl.Cl |
| InChIKey | KQRMNKAYUSDFBQ-UHFFFAOYSA-N |
Product Overview
Meproadifen mustard (CAS 105555-57-5), with molecular formula C22H29Cl2NO2 and molecular weight 409.16 g/mol. IUPAC: 2-[2-chloroethyl(methyl)amino]ethyl 2-[2-(1-phenylpropyl)phenyl]acetate;hydrochloride.
Chemical Property Profile of Meproadifen mustard
Property Insights of Meproadifen mustard
The XLogP value of 4.9066 indicates that Meproadifen mustard is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Meproadifen mustard exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Meproadifen mustard has 1 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 Meproadifen mustard?
The CAS number of Meproadifen mustard is 105555-57-5.
What is the molecular formula of Meproadifen mustard?
The molecular formula of Meproadifen mustard is C22H29Cl2NO2.
What is the molecular weight of Meproadifen mustard?
The molecular weight of Meproadifen mustard is 409.16 g/mol.
Where can I buy Meproadifen mustard?
You can request a quote for Meproadifen mustard directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Meproadifen mustard?
Yes, KEHONG BIO provides custom synthesis services for Meproadifen mustard and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.