BAS 00319419
TL;DR: BAS 00319419 (CAS 299904-95-3) is a chemical compound with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid
Also Known As: BAS 00319419, 3-[5-[(Z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-2-furyl]benzoic acid, 3-[5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid, 3-[5-[[4-Oxo-3-(2-propen-1-yl)-2-thioxo-5-thiazolidinylidene]methyl]-2-furanyl]benzoic Acid, Benzoic acid, 3-[5-[(Z)-[4-oxo-3-(2-propenyl)-2-thioxo-5-thiazolidinylidene]methyl]-2-furanyl]-
| Molecular Formula | C18H13NO4S2 |
|---|---|
| Molecular Weight | 371.03 g/mol |
| LogP | 4.032 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.0286 |
| Heavy Atoms | 25 |
| Complexity | 913.3048 |
Chemical Identifiers
| CAS Number | 299904-95-3 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C/C2=CC=C(O2)C3=CC(=CC=C3)C(=O)O)/SC1=S |
Product Overview
BAS 00319419 (CAS 299904-95-3), with molecular formula C18H13NO4S2 and molecular weight 371.03 g/mol. IUPAC: 3-[5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of BAS 00319419
Property Insights of BAS 00319419
The XLogP value of 4.032 indicates that BAS 00319419 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00319419. Following Lipinski's Rule of Five, BAS 00319419 has 1 hydrogen bond donor(s) and 5 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 BAS 00319419?
The CAS number of BAS 00319419 is 299904-95-3.
What is the molecular formula of BAS 00319419?
The molecular formula of BAS 00319419 is C18H13NO4S2.
What is the molecular weight of BAS 00319419?
The molecular weight of BAS 00319419 is 371.03 g/mol.
Where can I buy BAS 00319419?
You can request a quote for BAS 00319419 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00319419?
Yes, KEHONG BIO provides custom synthesis services for BAS 00319419 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.