A2107/0088548
TL;DR: A2107/0088548 (CAS 292876-96-1) is a chemical compound with molecular formula C29H26N2O5S and molecular weight 514.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-6-acetyl-2-[(3,4-dimethoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one
Also Known As: A2107/0088548, (2E)-6-acetyl-2-[(3,4-dimethoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one, 6-acetyl-2-(3,4-dimethoxybenzylidene)-5-(2-methoxy-1-naphthyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one, (2E)-6-acetyl-2-(3,4-dimethoxybenzylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
| Molecular Formula | C29H26N2O5S |
|---|---|
| Molecular Weight | 514.16 g/mol |
| LogP | 4.0032 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.15625 |
| Heavy Atoms | 37 |
| Complexity | 1763.3492 |
Chemical Identifiers
| CAS Number | 292876-96-1 |
|---|---|
| SMILES | CC1=C(C(N2C(=O)/C(=C\C3=CC(=C(C=C3)OC)OC)/SC2=N1)C4=C(C=CC5=CC=CC=C54)OC)C(=O)C |
Product Overview
A2107/0088548 (CAS 292876-96-1), with molecular formula C29H26N2O5S and molecular weight 514.16 g/mol. IUPAC: (2E)-6-acetyl-2-[(3,4-dimethoxyphenyl)methylidene]-5-(2-methoxynaphthalen-1-yl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one.
Chemical Property Profile of A2107/0088548
Property Insights of A2107/0088548
The XLogP value of 4.0032 indicates that A2107/0088548 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 A2107/0088548. Following Lipinski's Rule of Five, A2107/0088548 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 A2107/0088548?
The CAS number of A2107/0088548 is 292876-96-1.
What is the molecular formula of A2107/0088548?
The molecular formula of A2107/0088548 is C29H26N2O5S.
What is the molecular weight of A2107/0088548?
The molecular weight of A2107/0088548 is 514.16 g/mol.
Where can I buy A2107/0088548?
You can request a quote for A2107/0088548 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2107/0088548?
Yes, KEHONG BIO provides custom synthesis services for A2107/0088548 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.