![ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] structure](/static/products/832/83269-03-8.png)
ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]
TL;DR: ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] (CAS 83269-03-8) is a chemical compound with molecular formula C21H26N6O4 and molecular weight 426.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]-1,2-dihydropyrido[3,4-b]pyrazin-7-yl]carbamate
Also Known As: ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl], diethyl (3-{[methyl(phenyl)amino]methyl}-1,2-dihydropyrido[3,4-b]pyrazine-5,7-diyl)biscarbamate, Carbamic acid,2-dihydro-3-[(methylphenylamino)methyl]pyrido[3,4-b]pyrazine-5,7-diyl]bis-, diethyl ester, ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]-1,2-dihydropyrido[3,4-b]pyrazin-7-yl]carbamate
| Molecular Formula | C21H26N6O4 |
|---|---|
| Molecular Weight | 426.20 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 426.20154 |
| Heavy Atoms | 31 |
| Complexity | 639.0 |
Chemical Identifiers
| CAS Number | 83269-03-8 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C2C(=C1)NCC(=N2)CN(C)C3=CC=CC=C3)NC(=O)OCC |
| InChIKey | FPRJPWDEHSBSIK-UHFFFAOYSA-N |
Product Overview
ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] (CAS 83269-03-8), with molecular formula C21H26N6O4 and molecular weight 426.20 g/mol. IUPAC: ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]-1,2-dihydropyrido[3,4-b]pyrazin-7-yl]carbamate.
Chemical Property Profile of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]
Property Insights of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]. Following Lipinski's Rule of Five, ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] has 3 hydrogen bond donor(s) and 8 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 ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]?
The CAS number of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] is 83269-03-8.
What is the molecular formula of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]?
The molecular formula of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] is C21H26N6O4.
What is the molecular weight of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]?
The molecular weight of ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] is 426.20 g/mol.
Where can I buy ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]?
You can request a quote for ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl]?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[5-(ethoxycarbonylamino)-3-[(N-methylanilino)methyl] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.