BAS 00338751
TL;DR: BAS 00338751 (CAS 331234-65-2) is a chemical compound with molecular formula C17H13NO5S2 and molecular weight 375.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate
Also Known As: BAS 00338751, (Z)-4-((2,4-dioxothiazolidin-5-ylidene)methyl)phenyl 4-methylbenzenesulfonate, 4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzenesulfonate, [4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate, 4-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzenesulfonate
| Molecular Formula | C17H13NO5S2 |
|---|---|
| Molecular Weight | 375.02 g/mol |
| LogP | 3.08662 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.02353 |
| Heavy Atoms | 25 |
| Complexity | 961.1027 |
Chemical Identifiers
| CAS Number | 331234-65-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=C\3/C(=O)NC(=O)S3 |
Product Overview
BAS 00338751 (CAS 331234-65-2), with molecular formula C17H13NO5S2 and molecular weight 375.02 g/mol. IUPAC: [4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate.
Chemical Property Profile of BAS 00338751
Property Insights of BAS 00338751
The XLogP value of 3.08662 indicates that BAS 00338751 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00338751. Following Lipinski's Rule of Five, BAS 00338751 has 1 hydrogen bond donor(s) and 6 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 00338751?
The CAS number of BAS 00338751 is 331234-65-2.
What is the molecular formula of BAS 00338751?
The molecular formula of BAS 00338751 is C17H13NO5S2.
What is the molecular weight of BAS 00338751?
The molecular weight of BAS 00338751 is 375.02 g/mol.
Where can I buy BAS 00338751?
You can request a quote for BAS 00338751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00338751?
Yes, KEHONG BIO provides custom synthesis services for BAS 00338751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.