BAS 00601791
TL;DR: BAS 00601791 (CAS 321975-57-9) is a chemical compound with molecular formula C24H20N2O5S and molecular weight 448.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00601791, (E)-ethyl 2-(benzo[d][1,3]dioxol-5-ylmethylene)-7-methyl-3-oxo-5-phenyl-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 2-(1,3-benzodioxol-5-ylmethylene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C24H20N2O5S |
|---|---|
| Molecular Weight | 448.11 g/mol |
| LogP | 2.527 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.10928 |
| Heavy Atoms | 32 |
| Complexity | 1418.8016 |
Chemical Identifiers
| CAS Number | 321975-57-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C\C4=CC5=C(C=C4)OCO5)/S2)C |
Product Overview
BAS 00601791 (CAS 321975-57-9), with molecular formula C24H20N2O5S and molecular weight 448.11 g/mol. IUPAC: ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00601791
Property Insights of BAS 00601791
The XLogP value of 2.527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00601791. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00601791. Following Lipinski's Rule of Five, BAS 00601791 has 0 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 00601791?
The CAS number of BAS 00601791 is 321975-57-9.
What is the molecular formula of BAS 00601791?
The molecular formula of BAS 00601791 is C24H20N2O5S.
What is the molecular weight of BAS 00601791?
The molecular weight of BAS 00601791 is 448.11 g/mol.
Where can I buy BAS 00601791?
You can request a quote for BAS 00601791 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00601791?
Yes, KEHONG BIO provides custom synthesis services for BAS 00601791 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.