Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate
TL;DR: Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate (CAS 92515-62-3) is a chemical compound with molecular formula C17H34N2O4 and molecular weight 330.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[5-[(2-butoxy-2-oxoethyl)amino]pentylamino]acetate
Also Known As: butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate, dibutyl 2,2'-(pentane-1,5-diyldiimino)diacetate(non-preferred name), butyl 2-[5-[(2-butoxy-2-oxoethyl)amino]pentylamino]acetate
| Molecular Formula | C17H34N2O4 |
|---|---|
| Molecular Weight | 330.25 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 330.25186 |
| Heavy Atoms | 23 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 92515-62-3 |
|---|---|
| SMILES | CCCCOC(=O)CNCCCCCNCC(=O)OCCCC |
| InChIKey | MAAJGQAVUCXTLW-UHFFFAOYSA-N |
Product Overview
Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate (CAS 92515-62-3), with molecular formula C17H34N2O4 and molecular weight 330.25 g/mol. IUPAC: butyl 2-[5-[(2-butoxy-2-oxoethyl)amino]pentylamino]acetate.
Chemical Property Profile of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate
Property Insights of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate. Following Lipinski's Rule of Five, Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate 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 Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate?
The CAS number of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate is 92515-62-3.
What is the molecular formula of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate?
The molecular formula of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate is C17H34N2O4.
What is the molecular weight of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate?
The molecular weight of Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate is 330.25 g/mol.
Where can I buy Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate?
You can request a quote for Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-[5-(butoxycarbonylmethylamino)pentylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.