ChemDiv1_001388
TL;DR: ChemDiv1_001388 (CAS 328263-99-6) is a chemical compound with molecular formula C26H24N2O7S and molecular weight 508.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: ChemDiv1_001388, (Z)-ethyl 5-(benzo[d][1,3]dioxol-5-yl)-2-(2,4-dimethoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(2,4-dimethoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2Z)-5-(2H-1,3-BENZODIOXOL-5-YL)-2-[(2,4-DIMETHOXYPHENYL)METHYLIDENE]-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C26H24N2O7S |
|---|---|
| Molecular Weight | 508.13 g/mol |
| LogP | 2.5442 |
| Topological Polar Surface Area | 97.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.13043 |
| Heavy Atoms | 36 |
| Complexity | 1567.7736 |
Chemical Identifiers
| CAS Number | 328263-99-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)/C(=C/C5=C(C=C(C=C5)OC)OC)/S2)C |
Product Overview
ChemDiv1_001388 (CAS 328263-99-6), with molecular formula C26H24N2O7S and molecular weight 508.13 g/mol. IUPAC: ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of ChemDiv1_001388
Property Insights of ChemDiv1_001388
The XLogP value of 2.5442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_001388. The TPSA of 97.58 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_001388. Following Lipinski's Rule of Five, ChemDiv1_001388 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_001388?
The CAS number of ChemDiv1_001388 is 328263-99-6.
What is the molecular formula of ChemDiv1_001388?
The molecular formula of ChemDiv1_001388 is C26H24N2O7S.
What is the molecular weight of ChemDiv1_001388?
The molecular weight of ChemDiv1_001388 is 508.13 g/mol.
Where can I buy ChemDiv1_001388?
You can request a quote for ChemDiv1_001388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001388?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.