1,3-Bis(4-butoxyphenyl)thiourea
TL;DR: 1,3-Bis(4-butoxyphenyl)thiourea (CAS 3460-54-6) is a chemical compound with molecular formula C21H28N2O2S and molecular weight 372.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(4-butoxyphenyl)thiourea
Also Known As: 1,3-bis(4-butoxyphenyl)thiourea, N,N'-Bis(4-butoxyphenyl)thiourea, Su 1814, N,N'-Bis-4-n-butoxy-thiocarbanilid, Thiourea, N,N'-bis(4-butoxyphenyl)-
| Molecular Formula | C21H28N2O2S |
|---|---|
| Molecular Weight | 372.19 g/mol |
| LogP | 5.8533 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 372.18716 |
| Heavy Atoms | 26 |
| Complexity | 599.21625 |
Chemical Identifiers
| CAS Number | 3460-54-6 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCCC |
Product Overview
1,3-Bis(4-butoxyphenyl)thiourea (CAS 3460-54-6), with molecular formula C21H28N2O2S and molecular weight 372.19 g/mol. IUPAC: 1,3-bis(4-butoxyphenyl)thiourea.
Chemical Property Profile of 1,3-Bis(4-butoxyphenyl)thiourea
Property Insights of 1,3-Bis(4-butoxyphenyl)thiourea
The XLogP value of 5.8533 indicates that 1,3-Bis(4-butoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, 1,3-Bis(4-butoxyphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(4-butoxyphenyl)thiourea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Bis(4-butoxyphenyl)thiourea?
The CAS number of 1,3-Bis(4-butoxyphenyl)thiourea is 3460-54-6.
What is the molecular formula of 1,3-Bis(4-butoxyphenyl)thiourea?
The molecular formula of 1,3-Bis(4-butoxyphenyl)thiourea is C21H28N2O2S.
What is the molecular weight of 1,3-Bis(4-butoxyphenyl)thiourea?
The molecular weight of 1,3-Bis(4-butoxyphenyl)thiourea is 372.19 g/mol.
Where can I buy 1,3-Bis(4-butoxyphenyl)thiourea?
You can request a quote for 1,3-Bis(4-butoxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(4-butoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(4-butoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.