2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione
TL;DR: 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione (CAS 71376-46-0) is a chemical compound with molecular formula C23H40N2O3 and molecular weight 392.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione
Also Known As: 2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione, 2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,
| Molecular Formula | C23H40N2O3 |
|---|---|
| Molecular Weight | 392.30 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 392.3039 |
| Heavy Atoms | 28 |
| Complexity | 564.0 |
Chemical Identifiers
| CAS Number | 71376-46-0 |
|---|---|
| SMILES | CCCCCCCNC1=C(C(=O)C(=C(C1=O)OCC)NCCCCCCC)C |
| InChIKey | CDMKGZXAJSIKFQ-UHFFFAOYSA-N |
Product Overview
2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione (CAS 71376-46-0), with molecular formula C23H40N2O3 and molecular weight 392.30 g/mol. IUPAC: 2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione
Property Insights of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione
The XLogP value of 7.1 indicates that 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione. Following Lipinski's Rule of Five, 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione?
The CAS number of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione is 71376-46-0.
What is the molecular formula of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione is C23H40N2O3.
What is the molecular weight of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione is 392.30 g/mol.
Where can I buy 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.