1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)
TL;DR: 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) (CAS 65446-91-5) is a chemical compound with molecular formula C28H49ClN2O3 and molecular weight 496.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,5-bis(dibutylamino)-5-oxopentan-2-yl] benzoate;hydrochloride
Also Known As: 4-(Benzoyloxy)-N,N-dibutyl-5-(dibutylamino)pentanamide monohydrochloride, Pentanamide, 4-(benzoyloxy)-N,N-dibutyl-5-(dibutylamino)-, monohydrochloride, 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1), [1,5-bis(dibutylamino)-5-oxopentan-2-yl] benzoate hydrochloride, RefChem:1053421
| Molecular Formula | C28H49ClN2O3 |
|---|---|
| Molecular Weight | 496.34 g/mol |
| LogP | 6.745 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 496.34317 |
| Heavy Atoms | 34 |
| Complexity | 625.7982 |
Chemical Identifiers
| CAS Number | 65446-91-5 |
|---|---|
| SMILES | CCCCN(CCCC)CC(CCC(=O)N(CCCC)CCCC)OC(=O)C1=CC=CC=C1.Cl |
Product Overview
1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) (CAS 65446-91-5), with molecular formula C28H49ClN2O3 and molecular weight 496.34 g/mol. IUPAC: [1,5-bis(dibutylamino)-5-oxopentan-2-yl] benzoate;hydrochloride.
Chemical Property Profile of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)
Property Insights of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)
The XLogP value of 6.745 indicates that 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)?
The CAS number of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) is 65446-91-5.
What is the molecular formula of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)?
The molecular formula of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) is C28H49ClN2O3.
What is the molecular weight of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)?
The molecular weight of 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) is 496.34 g/mol.
Where can I buy 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)?
You can request a quote for 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Bis(dibutylamino)-5-oxopentan-2-yl benzoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.