(2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride
TL;DR: (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride (CAS 258347-48-7) is a chemical compound with molecular formula C24H28Cl2N4S2 and molecular weight 506.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,5-dimethyl-4-[(N'-phenylcarbamimidoyl)sulfanylmethyl]phenyl]methyl N'-phenylcarbamimidothioate;dihydrochloride
Also Known As: (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride, (2,5-Dimethyl-1,4-phenylene)bis(methylene)bis(phenylcarbamimidothioate)dihydrochloride, [2,5-dimethyl-4-[(N'-phenylcarbamimidoyl)sulfanylmethyl]phenyl]methyl N'-phenylcarbamimidothioate dihydrochloride
| Molecular Formula | C24H28Cl2N4S2 |
|---|---|
| Molecular Weight | 506.11 g/mol |
| LogP | 6.90624 |
| Topological Polar Surface Area | 76.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.11325 |
| Heavy Atoms | 32 |
| Complexity | 957.3747 |
Chemical Identifiers
| CAS Number | 258347-48-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1CSC(=NC2=CC=CC=C2)N)C)CSC(=NC3=CC=CC=C3)N.Cl.Cl |
Product Overview
(2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride (CAS 258347-48-7), with molecular formula C24H28Cl2N4S2 and molecular weight 506.11 g/mol. IUPAC: [2,5-dimethyl-4-[(N'-phenylcarbamimidoyl)sulfanylmethyl]phenyl]methyl N'-phenylcarbamimidothioate;dihydrochloride.
Chemical Property Profile of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride
Property Insights of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride
The XLogP value of 6.90624 indicates that (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride. Following Lipinski's Rule of Five, (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride?
The CAS number of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride is 258347-48-7.
What is the molecular formula of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride?
The molecular formula of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride is C24H28Cl2N4S2.
What is the molecular weight of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride?
The molecular weight of (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride is 506.11 g/mol.
Where can I buy (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride?
You can request a quote for (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (2,5-Dimethyl-1,4-phenylene)bis(methylene) bis(phenylcarbamimidothioate) dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.