Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide
TL;DR: Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide (CAS 908-20-3) is a chemical compound with molecular formula C18H22Br2Cl2N4S2 and molecular weight 585.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[N'-(3-chlorophenyl)carbamimidoyl]sulfanylbutyl N'-(3-chlorophenyl)carbamimidothioate;dihydrobromide
Also Known As: 1,4-Butylene-bis-m-chlorophenyl isothiuronium dihydrobromide, 2,2'-Butylenebis(1-(m-chlorophenyl)-2-thiopseudourea) dihydrobromide, Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide, butane-1,4-diyl bis[n'-(3-chlorophenyl)carbamimidothioate] dihydrobromide, Butane-1,4-diyl bis[N-(3-chlorophenyl)carbamimidothioate]--hydrogen bromide (1/2)
| Molecular Formula | C18H22Br2Cl2N4S2 |
|---|---|
| Molecular Weight | 585.90 g/mol |
| LogP | 6.99 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 587.90094 |
| Heavy Atoms | 28 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 908-20-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N=C(N)SCCCCSC(=NC2=CC(=CC=C2)Cl)N.Br.Br |
| InChIKey | YMEXUPXHERQSSS-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide (CAS 908-20-3), with molecular formula C18H22Br2Cl2N4S2 and molecular weight 585.90 g/mol. IUPAC: 4-[N'-(3-chlorophenyl)carbamimidoyl]sulfanylbutyl N'-(3-chlorophenyl)carbamimidothioate;dihydrobromide.
Chemical Property Profile of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide
Property Insights of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide
The XLogP value of 6.99 indicates that Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide has 4 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 Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide?
The CAS number of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide is 908-20-3.
What is the molecular formula of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide?
The molecular formula of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide is C18H22Br2Cl2N4S2.
What is the molecular weight of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide?
The molecular weight of Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide is 585.90 g/mol.
Where can I buy Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide?
You can request a quote for Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2,2'-butylenebis(1-(m-chlorophenyl)-2-thio-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.