BIM-0048229.P001
TL;DR: BIM-0048229.P001 (CAS 5901-32-6) is a chemical compound with molecular formula C18H14N2O6S2 and molecular weight 418.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BIM-0048229.P001, 5-(2-hydroxy-3-methoxy-5-nitrobenzylidene)-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H14N2O6S2 |
|---|---|
| Molecular Weight | 418.03 g/mol |
| LogP | 3.7234 |
| Topological Polar Surface Area | 102.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.02933 |
| Heavy Atoms | 28 |
| Complexity | 1003.88055 |
Chemical Identifiers
| CAS Number | 5901-32-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(C(=CC(=C3)[N+](=O)[O-])OC)O)/SC2=S |
Product Overview
BIM-0048229.P001 (CAS 5901-32-6), with molecular formula C18H14N2O6S2 and molecular weight 418.03 g/mol. IUPAC: (5Z)-5-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-(4-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BIM-0048229.P001
Property Insights of BIM-0048229.P001
The XLogP value of 3.7234 indicates that BIM-0048229.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.14 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0048229.P001. Following Lipinski's Rule of Five, BIM-0048229.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-0048229.P001?
The CAS number of BIM-0048229.P001 is 5901-32-6.
What is the molecular formula of BIM-0048229.P001?
The molecular formula of BIM-0048229.P001 is C18H14N2O6S2.
What is the molecular weight of BIM-0048229.P001?
The molecular weight of BIM-0048229.P001 is 418.03 g/mol.
Where can I buy BIM-0048229.P001?
You can request a quote for BIM-0048229.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0048229.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0048229.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.