CDS1_004400
TL;DR: CDS1_004400 (CAS 352012-95-4) is a chemical compound with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-[[2-(2,5-dimethoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid
Also Known As: CDS1_004400, BIM-0023943.P001, 4-[(E)-(2-{[(2,5-dimethoxyphenyl)amino](oxo)acetyl}hydrazinylidene)methyl]benzoic acid, (E)-4-((2-(2-((2,5-dimethoxyphenyl)amino)-2-oxoacetyl)hydrazono)methyl)benzoic acid, 4-[(E)-[[2-(2,5-dimethoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid
| Molecular Formula | C18H17N3O6 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 1.4908 |
| Topological Polar Surface Area | 126.32 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.11172 |
| Heavy Atoms | 27 |
| Complexity | 877.1657 |
Chemical Identifiers
| CAS Number | 352012-95-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)NC(=O)C(=O)N/N=C/C2=CC=C(C=C2)C(=O)O |
Product Overview
CDS1_004400 (CAS 352012-95-4), with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol. IUPAC: 4-[(E)-[[2-(2,5-dimethoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid.
Chemical Property Profile of CDS1_004400
Property Insights of CDS1_004400
The XLogP value of 1.4908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CDS1_004400. The TPSA of 126.32 Ų falls within the moderate polarity range, balancing permeability and solubility for CDS1_004400. Following Lipinski's Rule of Five, CDS1_004400 has 3 hydrogen bond donor(s) and 6 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 CDS1_004400?
The CAS number of CDS1_004400 is 352012-95-4.
What is the molecular formula of CDS1_004400?
The molecular formula of CDS1_004400 is C18H17N3O6.
What is the molecular weight of CDS1_004400?
The molecular weight of CDS1_004400 is 371.11 g/mol.
Where can I buy CDS1_004400?
You can request a quote for CDS1_004400 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_004400?
Yes, KEHONG BIO provides custom synthesis services for CDS1_004400 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.