A1669/0071181
TL;DR: A1669/0071181 (CAS 311790-52-0) is a chemical compound with molecular formula C23H19IN2O3S and molecular weight 530.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(4-iodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: A1669/0071181, ethyl (2Z)-2-[(4-iodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 2-(4-iodobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-ethyl 2-(4-iodobenzylidene)-7-methyl-3-oxo-5-phenyl-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-2-(4-iodobenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C23H19IN2O3S |
|---|---|
| Molecular Weight | 530.02 g/mol |
| LogP | 3.4029 |
| Topological Polar Surface Area | 60.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 530.0161 |
| Heavy Atoms | 30 |
| Complexity | 1305.2184 |
Chemical Identifiers
| CAS Number | 311790-52-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC=C(C=C4)I)/S2)C |
Product Overview
A1669/0071181 (CAS 311790-52-0), with molecular formula C23H19IN2O3S and molecular weight 530.02 g/mol. IUPAC: ethyl (2Z)-2-[(4-iodophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of A1669/0071181
Property Insights of A1669/0071181
The XLogP value of 3.4029 indicates that A1669/0071181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.66 Ų falls within the moderate polarity range, balancing permeability and solubility for A1669/0071181. Following Lipinski's Rule of Five, A1669/0071181 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1669/0071181?
The CAS number of A1669/0071181 is 311790-52-0.
What is the molecular formula of A1669/0071181?
The molecular formula of A1669/0071181 is C23H19IN2O3S.
What is the molecular weight of A1669/0071181?
The molecular weight of A1669/0071181 is 530.02 g/mol.
Where can I buy A1669/0071181?
You can request a quote for A1669/0071181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1669/0071181?
Yes, KEHONG BIO provides custom synthesis services for A1669/0071181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.