BAS 02266399
TL;DR: BAS 02266399 (CAS 364617-96-9) is a chemical compound with molecular formula C20H16N4O4S and molecular weight 408.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-[(Z)-(2-ethyl-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate
Also Known As: BAS 02266399, BIM-0010183.P001, (Z)-methyl 2-(5-((2-ethyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)furan-2-yl)benzoate, methyl 2-[5-[(Z)-(2-ethyl-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate, methyl 2-{5-[(Z)-(2-ethyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]furan-2-yl}benzoate
| Molecular Formula | C20H16N4O4S |
|---|---|
| Molecular Weight | 408.09 g/mol |
| LogP | 3.76237 |
| Topological Polar Surface Area | 108.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.08923 |
| Heavy Atoms | 29 |
| Complexity | 1129.0059 |
Chemical Identifiers
| CAS Number | 364617-96-9 |
|---|---|
| SMILES | CCC1=NN2C(=N)/C(=C/C3=CC=C(O3)C4=CC=CC=C4C(=O)OC)/C(=O)N=C2S1 |
Product Overview
BAS 02266399 (CAS 364617-96-9), with molecular formula C20H16N4O4S and molecular weight 408.09 g/mol. IUPAC: methyl 2-[5-[(Z)-(2-ethyl-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene)methyl]furan-2-yl]benzoate.
Chemical Property Profile of BAS 02266399
Property Insights of BAS 02266399
The XLogP value of 3.76237 indicates that BAS 02266399 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.32 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02266399. Following Lipinski's Rule of Five, BAS 02266399 has 1 hydrogen bond donor(s) and 7 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 02266399?
The CAS number of BAS 02266399 is 364617-96-9.
What is the molecular formula of BAS 02266399?
The molecular formula of BAS 02266399 is C20H16N4O4S.
What is the molecular weight of BAS 02266399?
The molecular weight of BAS 02266399 is 408.09 g/mol.
Where can I buy BAS 02266399?
You can request a quote for BAS 02266399 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02266399?
Yes, KEHONG BIO provides custom synthesis services for BAS 02266399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.