![Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate structure](/static/products/878/878690-95-0.png)
Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate
TL;DR: Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate (CAS 878690-95-0) is a chemical compound with molecular formula C22H27N3O5 and molecular weight 413.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3,5-dimethoxybenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate
Also Known As: ASN 11194191, AP-970/43268242, METHYL 3-(3,5-DIMETHOXYBENZAMIDO)-4-(4-METHYLPIPERAZIN-1-YL)BENZOATE, methyl 3-[(3,5-dimethoxybenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate, methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate
| Molecular Formula | C22H27N3O5 |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 2.4945 |
| Topological Polar Surface Area | 80.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.19507 |
| Heavy Atoms | 30 |
| Complexity | 900.7342 |
Chemical Identifiers
| CAS Number | 878690-95-0 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC(=C3)OC)OC |
Product Overview
Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate (CAS 878690-95-0), with molecular formula C22H27N3O5 and molecular weight 413.20 g/mol. IUPAC: methyl 3-[(3,5-dimethoxybenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate.
Chemical Property Profile of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate
Property Insights of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate
The XLogP value of 2.4945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate. The TPSA of 80.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate. Following Lipinski's Rule of Five, Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate has 1 hydrogen bond donor(s) and 7 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 Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate?
The CAS number of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate is 878690-95-0.
What is the molecular formula of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate?
The molecular formula of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate is C22H27N3O5.
What is the molecular weight of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate?
The molecular weight of Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate is 413.20 g/mol.
Where can I buy Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate?
You can request a quote for Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(3,5-dimethoxyphenyl)carbonylamino]-4-(4-methylpiperazinyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.