BAS 02066989
TL;DR: BAS 02066989 (CAS 338427-26-2) is a chemical compound with molecular formula C23H22N4O3S3 and molecular weight 498.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide
Also Known As: BAS 02066989, (Z)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)butanamide, AB00102652-01, F0881-0067, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]butanamide
| Molecular Formula | C23H22N4O3S3 |
|---|---|
| Molecular Weight | 498.09 g/mol |
| LogP | 4.16602 |
| Topological Polar Surface Area | 76.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.08542 |
| Heavy Atoms | 33 |
| Complexity | 1290.4558 |
Chemical Identifiers
| CAS Number | 338427-26-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCCN3C(=O)/C(=C/C4=CC=CS4)/SC3=S |
Product Overview
BAS 02066989 (CAS 338427-26-2), with molecular formula C23H22N4O3S3 and molecular weight 498.09 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide.
Chemical Property Profile of BAS 02066989
Property Insights of BAS 02066989
The XLogP value of 4.16602 indicates that BAS 02066989 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02066989. Following Lipinski's Rule of Five, BAS 02066989 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 02066989?
The CAS number of BAS 02066989 is 338427-26-2.
What is the molecular formula of BAS 02066989?
The molecular formula of BAS 02066989 is C23H22N4O3S3.
What is the molecular weight of BAS 02066989?
The molecular weight of BAS 02066989 is 498.09 g/mol.
Where can I buy BAS 02066989?
You can request a quote for BAS 02066989 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02066989?
Yes, KEHONG BIO provides custom synthesis services for BAS 02066989 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.