BIM-0008989.P001
TL;DR: BIM-0008989.P001 (CAS 202056-56-2) is a chemical compound with molecular formula C21H16ClN3O4S2 and molecular weight 473.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid
Also Known As: BIM-0008989.P001, 4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid, 4-[({[{[(4-chlorophenyl)sulfonyl]imino}(phenyl)methyl]amino}carbonothioyl)amino]benzoic acid
| Molecular Formula | C21H16ClN3O4S2 |
|---|---|
| Molecular Weight | 473.03 g/mol |
| LogP | 4.1603 |
| Topological Polar Surface Area | 107.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.02707 |
| Heavy Atoms | 31 |
| Complexity | 1227.8812 |
Chemical Identifiers
| CAS Number | 202056-56-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=N\S(=O)(=O)C2=CC=C(C=C2)Cl)/NC(=S)NC3=CC=C(C=C3)C(=O)O |
Product Overview
BIM-0008989.P001 (CAS 202056-56-2), with molecular formula C21H16ClN3O4S2 and molecular weight 473.03 g/mol. IUPAC: 4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid.
Chemical Property Profile of BIM-0008989.P001
Property Insights of BIM-0008989.P001
The XLogP value of 4.1603 indicates that BIM-0008989.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0008989.P001. Following Lipinski's Rule of Five, BIM-0008989.P001 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 BIM-0008989.P001?
The CAS number of BIM-0008989.P001 is 202056-56-2.
What is the molecular formula of BIM-0008989.P001?
The molecular formula of BIM-0008989.P001 is C21H16ClN3O4S2.
What is the molecular weight of BIM-0008989.P001?
The molecular weight of BIM-0008989.P001 is 473.03 g/mol.
Where can I buy BIM-0008989.P001?
You can request a quote for BIM-0008989.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0008989.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0008989.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.