BIM-0044941.P001
TL;DR: BIM-0044941.P001 (CAS 6093-17-0) is a chemical compound with molecular formula C16H10N2O6S3 and molecular weight 421.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-nitrobenzenesulfonate
Also Known As: BIM-0044941.P001, 2-[(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-nitrobenzenesulfonate, [2-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-nitrobenzenesulfonate
| Molecular Formula | C16H10N2O6S3 |
|---|---|
| Molecular Weight | 421.97 g/mol |
| LogP | 2.8513 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.9701 |
| Heavy Atoms | 27 |
| Complexity | 1077.5894 |
Chemical Identifiers
| CAS Number | 6093-17-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=S)S2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
BIM-0044941.P001 (CAS 6093-17-0), with molecular formula C16H10N2O6S3 and molecular weight 421.97 g/mol. IUPAC: [2-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-nitrobenzenesulfonate.
Chemical Property Profile of BIM-0044941.P001
Property Insights of BIM-0044941.P001
The XLogP value of 2.8513 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0044941.P001. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044941.P001. Following Lipinski's Rule of Five, BIM-0044941.P001 has 1 hydrogen bond donor(s) and 8 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-0044941.P001?
The CAS number of BIM-0044941.P001 is 6093-17-0.
What is the molecular formula of BIM-0044941.P001?
The molecular formula of BIM-0044941.P001 is C16H10N2O6S3.
What is the molecular weight of BIM-0044941.P001?
The molecular weight of BIM-0044941.P001 is 421.97 g/mol.
Where can I buy BIM-0044941.P001?
You can request a quote for BIM-0044941.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044941.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044941.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.