BAS 00602168
TL;DR: BAS 00602168 (CAS 331820-67-8) is a chemical compound with molecular formula C27H24I2N2O5S and molecular weight 741.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(3,5-diiodo-4-prop-2-enoxyphenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: BAS 00602168, (Z)-ethyl 2-(4-(allyloxy)-3,5-diiodobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-[(3,5-diiodo-4-prop-2-enoxyphenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-[3,5-diiodo-4-(prop-2-en-1-yloxy)benzylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C27H24I2N2O5S |
|---|---|
| Molecular Weight | 741.95 g/mol |
| LogP | 4.5809 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 741.9495 |
| Heavy Atoms | 37 |
| Complexity | 1548.431 |
Chemical Identifiers
| CAS Number | 331820-67-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)/C(=C/C4=CC(=C(C(=C4)I)OCC=C)I)/S2)C |
Product Overview
BAS 00602168 (CAS 331820-67-8), with molecular formula C27H24I2N2O5S and molecular weight 741.95 g/mol. IUPAC: ethyl (2Z)-2-[(3,5-diiodo-4-prop-2-enoxyphenyl)methylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of BAS 00602168
Property Insights of BAS 00602168
The XLogP value of 4.5809 indicates that BAS 00602168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00602168. Following Lipinski's Rule of Five, BAS 00602168 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00602168?
The CAS number of BAS 00602168 is 331820-67-8.
What is the molecular formula of BAS 00602168?
The molecular formula of BAS 00602168 is C27H24I2N2O5S.
What is the molecular weight of BAS 00602168?
The molecular weight of BAS 00602168 is 741.95 g/mol.
Where can I buy BAS 00602168?
You can request a quote for BAS 00602168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00602168?
Yes, KEHONG BIO provides custom synthesis services for BAS 00602168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.