BAS 00273443
TL;DR: BAS 00273443 (CAS 309936-17-2) is a chemical compound with molecular formula C20H14BrNO3S2 and molecular weight 458.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-bromobenzoate
Also Known As: BAS 00273443, BIM-0009377.P001, 4-[(3-allyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-bromobenzoate, [4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-bromobenzoate, (E)-4-((3-allyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)phenyl 3-bromobenzoate
| Molecular Formula | C20H14BrNO3S2 |
|---|---|
| Molecular Weight | 458.96 g/mol |
| LogP | 5.0555 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.95984 |
| Heavy Atoms | 27 |
| Complexity | 953.9541 |
Chemical Identifiers
| CAS Number | 309936-17-2 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C\C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)/SC1=S |
Product Overview
BAS 00273443 (CAS 309936-17-2), with molecular formula C20H14BrNO3S2 and molecular weight 458.96 g/mol. IUPAC: [4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-bromobenzoate.
Chemical Property Profile of BAS 00273443
Property Insights of BAS 00273443
The XLogP value of 5.0555 indicates that BAS 00273443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, BAS 00273443 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00273443 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00273443?
The CAS number of BAS 00273443 is 309936-17-2.
What is the molecular formula of BAS 00273443?
The molecular formula of BAS 00273443 is C20H14BrNO3S2.
What is the molecular weight of BAS 00273443?
The molecular weight of BAS 00273443 is 458.96 g/mol.
Where can I buy BAS 00273443?
You can request a quote for BAS 00273443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00273443?
Yes, KEHONG BIO provides custom synthesis services for BAS 00273443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.