Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate
TL;DR: Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate (CAS 6724-91-0) is a chemical compound with molecular formula C24H28N2O6 and molecular weight 440.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[6-[(4-methoxycarbonylbenzoyl)amino]hexylcarbamoyl]benzoate
Also Known As: Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate, dimethyl 4,4'-(hexane-1,6-diyldicarbamoyl)dibenzoate, methyl 4-[6-[(4-methoxycarbonylbenzoyl)amino]hexylcarbamoyl]benzoate, DIMETHYL 4,4'-[1,6-HEXANEDIYLBIS(IMINOCARBONYL)]BISBENZOATE, 4,4 -[1,6-Hexanediylbis(iminocarbonyl)]bis(benzoic acid methyl) ester
| Molecular Formula | C24H28N2O6 |
|---|---|
| Molecular Weight | 440.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 440.19473 |
| Heavy Atoms | 32 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 6724-91-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)NCCCCCCNC(=O)C2=CC=C(C=C2)C(=O)OC |
| InChIKey | TYXXDPQEUBEJHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate (CAS 6724-91-0), with molecular formula C24H28N2O6 and molecular weight 440.19 g/mol. IUPAC: methyl 4-[6-[(4-methoxycarbonylbenzoyl)amino]hexylcarbamoyl]benzoate.
Chemical Property Profile of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate
Property Insights of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate
The XLogP value of 3.3 indicates that Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate. Following Lipinski's Rule of Five, Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate has 2 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 Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate?
The CAS number of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate is 6724-91-0.
What is the molecular formula of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate?
The molecular formula of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate is C24H28N2O6.
What is the molecular weight of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate?
The molecular weight of Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate is 440.19 g/mol.
Where can I buy Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate?
You can request a quote for Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4,4'-(1,6-hexanediylbis(iminocarbonyl))bisbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.