Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride
TL;DR: Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride (CAS 26962-13-0) is a chemical compound with molecular formula C23H34ClN3O2S and molecular weight 451.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-butoxyphenyl)-3-[3-(diethylaminomethyl)-4-methoxyphenyl]thiourea;hydrochloride
Also Known As: Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride, 3-(Diethylamino)methyl-4'-butoxy-4-methoxythiocarbanilide hydrochloride, 1-(p-Butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thiourea hydrochloride, 1-(4-butoxyphenyl)-3-[3-(diethylaminomethyl)-4-methoxyphenyl]thiourea hydrochloride, N-(4-Butoxyphenyl)-N'-{3-[(diethylamino)methyl]-4-methoxyphenyl}thiourea--hydrogen chloride (1/1)
| Molecular Formula | C23H34ClN3O2S |
|---|---|
| Molecular Weight | 451.21 g/mol |
| LogP | 5.9466 |
| Topological Polar Surface Area | 45.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 451.20602 |
| Heavy Atoms | 30 |
| Complexity | 767.5436 |
Chemical Identifiers
| CAS Number | 26962-13-0 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OC)CN(CC)CC.Cl |
Product Overview
Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride (CAS 26962-13-0), with molecular formula C23H34ClN3O2S and molecular weight 451.21 g/mol. IUPAC: 1-(4-butoxyphenyl)-3-[3-(diethylaminomethyl)-4-methoxyphenyl]thiourea;hydrochloride.
Chemical Property Profile of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride
Property Insights of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride
The XLogP value of 5.9466 indicates that Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.76 Ų, Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride 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 Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride?
The CAS number of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride is 26962-13-0.
What is the molecular formula of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride?
The molecular formula of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride is C23H34ClN3O2S.
What is the molecular weight of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride?
The molecular weight of Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride is 451.21 g/mol.
Where can I buy Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride?
You can request a quote for Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(p-butoxyphenyl)-3-(3-(diethylamino)methyl-4-methoxyphenyl)-2-thio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.