![Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate structure](/static/products/252/25266-67-5.png)
Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate
TL;DR: Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate (CAS 25266-67-5) 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.
diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate
Also Known As: Cyclopentacyclopentadecene,octadecahydro, diethyl n-{4-[(pyridin-3-ylmethyl)amino]benzoyl}glutamate, diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate, 1,3-dimethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C22H27N3O5 |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 413.19507 |
| Heavy Atoms | 30 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 25266-67-5 |
|---|---|
| SMILES | CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCC2=CN=CC=C2 |
| InChIKey | SUUXFABDEDYGKT-UHFFFAOYSA-N |
Product Overview
Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate (CAS 25266-67-5), with molecular formula C22H27N3O5 and molecular weight 413.20 g/mol. IUPAC: diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate.
Chemical Property Profile of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate
Property Insights of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate. Following Lipinski's Rule of Five, Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate has 2 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 Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate?
The CAS number of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate is 25266-67-5.
What is the molecular formula of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate?
The molecular formula of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate is C22H27N3O5.
What is the molecular weight of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate?
The molecular weight of Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate is 413.20 g/mol.
Where can I buy Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate?
You can request a quote for Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[[4-(pyridin-3-ylmethylamino)benzoyl]amino]pentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.