RefChem:295870
TL;DR: RefChem:295870 (CAS 28143-74-0) is a chemical compound with molecular formula C30H46Cl2N2O2 and molecular weight 536.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] benzoate;dihydrochloride
Also Known As: 5-Dibutylaminomethyl-4-phenyl-1,2,5-trimethyl-4-piperidinol, benzoate, dihydrochloride, 4-Piperidinol, 5-dibutylaminomethyl-4-phenyl-1,2,5-trimethyl-, benzoate, dihydrochloride, 5-Dibutylaminomethyl-4-hydroxy-4-phenyl-1,2,5-trimethylpiperidine, benzoate, dihydrochloride, [5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] benzoate dihydrochloride, 4-Piperidinol, 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-, benzoate (ester), dihydrochloride
| Molecular Formula | C30H46Cl2N2O2 |
|---|---|
| Molecular Weight | 536.29 g/mol |
| LogP | 7.215 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 536.29364 |
| Heavy Atoms | 36 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 28143-74-0 |
|---|---|
| SMILES | CCCCN(CCCC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C)C)C.Cl.Cl |
| InChIKey | UANICKNGGXOEOU-UHFFFAOYSA-N |
Product Overview
RefChem:295870 (CAS 28143-74-0), with molecular formula C30H46Cl2N2O2 and molecular weight 536.29 g/mol. IUPAC: [5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] benzoate;dihydrochloride.
Chemical Property Profile of RefChem:295870
Property Insights of RefChem:295870
The XLogP value of 7.215 indicates that RefChem:295870 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, RefChem:295870 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:295870 has 2 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 RefChem:295870?
The CAS number of RefChem:295870 is 28143-74-0.
What is the molecular formula of RefChem:295870?
The molecular formula of RefChem:295870 is C30H46Cl2N2O2.
What is the molecular weight of RefChem:295870?
The molecular weight of RefChem:295870 is 536.29 g/mol.
Where can I buy RefChem:295870?
You can request a quote for RefChem:295870 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:295870?
Yes, KEHONG BIO provides custom synthesis services for RefChem:295870 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.