![5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID structure](/static/products/5315/531535-76-9.webp)
5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID
TL;DR: 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID (CAS 531535-76-9) is a chemical compound with molecular formula C17H10Cl2N2O3S2 and molecular weight 423.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]benzoic acid
Also Known As: 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID, 5-chloro-2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]benzoic acid, 5-chloro-2-[(3-chlorobenzothiophene-2-carbonyl)thiocarbamoylamino]benzoic Acid, 5-Chloro-2-[[[[(3-chlorobenzo[b]thien-2-yl)carbonyl ]amino]thioxomethyl ]amino]-benzoic acid
| Molecular Formula | C17H10Cl2N2O3S2 |
|---|---|
| Molecular Weight | 423.95 g/mol |
| LogP | 5.0331 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.951 |
| Heavy Atoms | 26 |
| Complexity | 1049.6641 |
Chemical Identifiers
| CAS Number | 531535-76-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NC3=C(C=C(C=C3)Cl)C(=O)O)Cl |
Product Overview
5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID (CAS 531535-76-9), with molecular formula C17H10Cl2N2O3S2 and molecular weight 423.95 g/mol. IUPAC: 5-chloro-2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]benzoic acid.
Chemical Property Profile of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID
Property Insights of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID
The XLogP value of 5.0331 indicates that 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID. Following Lipinski's Rule of Five, 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID has 3 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 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID?
The CAS number of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID is 531535-76-9.
What is the molecular formula of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID?
The molecular formula of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID is C17H10Cl2N2O3S2.
What is the molecular weight of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID?
The molecular weight of 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID is 423.95 g/mol.
Where can I buy 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID?
You can request a quote for 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID?
Yes, KEHONG BIO provides custom synthesis services for 5-CHLORO-2-[[[[ CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.