1-Butan-2-yl-3-(2-chlorophenyl)thiourea
TL;DR: 1-Butan-2-yl-3-(2-chlorophenyl)thiourea (CAS 690688-23-4) is a chemical compound with molecular formula C11H15ClN2S and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-3-(2-chlorophenyl)thiourea
Also Known As: 1-butan-2-yl-3-(2-chlorophenyl)thiourea, 3-(butan-2-yl)-1-(2-chlorophenyl)thiourea
| Molecular Formula | C11H15ClN2S |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 3.4249 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.06445 |
| Heavy Atoms | 15 |
| Complexity | 341.11475 |
Chemical Identifiers
| CAS Number | 690688-23-4 |
|---|---|
| SMILES | CCC(C)NC(=S)NC1=CC=CC=C1Cl |
Product Overview
1-Butan-2-yl-3-(2-chlorophenyl)thiourea (CAS 690688-23-4), with molecular formula C11H15ClN2S and molecular weight 242.06 g/mol. IUPAC: 1-butan-2-yl-3-(2-chlorophenyl)thiourea.
Chemical Property Profile of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea
Property Insights of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea
The XLogP value of 3.4249 indicates that 1-Butan-2-yl-3-(2-chlorophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-Butan-2-yl-3-(2-chlorophenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butan-2-yl-3-(2-chlorophenyl)thiourea has 2 hydrogen bond donor(s) and 1 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 1-Butan-2-yl-3-(2-chlorophenyl)thiourea?
The CAS number of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea is 690688-23-4.
What is the molecular formula of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea?
The molecular formula of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea is C11H15ClN2S.
What is the molecular weight of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea?
The molecular weight of 1-Butan-2-yl-3-(2-chlorophenyl)thiourea is 242.06 g/mol.
Where can I buy 1-Butan-2-yl-3-(2-chlorophenyl)thiourea?
You can request a quote for 1-Butan-2-yl-3-(2-chlorophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butan-2-yl-3-(2-chlorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Butan-2-yl-3-(2-chlorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.