![1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea structure](/static/products/7082/708228-16-4.webp)
1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea
TL;DR: 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea (CAS 708228-16-4) is a chemical compound with molecular formula C15H11BrClN3O2S2 and molecular weight 442.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea
Also Known As: 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea, 3-[(4-bromo-3-chloro-benzothiophene-2-carbonyl)amino]-1-(2-furylmethyl)thiourea, (4-bromo-3-chlorobenzo[b]thiophen-2-yl)-N-({[(2-furylmethyl)amino]thioxomethyl }amino)carboxamide, 2-[(4-bromo-3-chloro-1-benzothiophen-2-yl)carbonyl]-N-(furan-2-ylmethyl)hydrazinecarbothioamide
| Molecular Formula | C15H11BrClN3O2S2 |
|---|---|
| Molecular Weight | 442.92 g/mol |
| LogP | 4.2193 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 442.91647 |
| Heavy Atoms | 24 |
| Complexity | 895.65137 |
Chemical Identifiers
| CAS Number | 708228-16-4 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Br)C(=C(S2)C(=O)NNC(=S)NCC3=CC=CO3)Cl |
Product Overview
1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea (CAS 708228-16-4), with molecular formula C15H11BrClN3O2S2 and molecular weight 442.92 g/mol. IUPAC: 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea.
Chemical Property Profile of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea
Property Insights of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea
The XLogP value of 4.2193 indicates that 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea. Following Lipinski's Rule of Five, 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea has 3 hydrogen bond donor(s) and 4 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-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea?
The CAS number of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea is 708228-16-4.
What is the molecular formula of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea?
The molecular formula of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea is C15H11BrClN3O2S2.
What is the molecular weight of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea?
The molecular weight of 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea is 442.92 g/mol.
Where can I buy 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea?
You can request a quote for 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-bromo-3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(furan-2-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.