RefChem:380922
TL;DR: RefChem:380922 (CAS 64036-57-3) is a chemical compound with molecular formula C25H29NO6 and molecular weight 439.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)piperidine
Also Known As: KST-1B7044, 2-[4-(acetyloxy)-3-tert-butylphenoxy]tetradecanoic acid, 1-(10,11-dihydrospiro[dibenzo[a,d][7]annulene-5,2'-[1,3]dioxolan]-4'-ylmethyl)piperidine ethanedioate(1:1), Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 10,11-dihydro-4'-piperidinomethyl-, oxalate, Oxalic acid--1-[(10,11-dihydrospiro[dibenzo[a,d][7]annulene-5,2'-[1,3]dioxolan]-4'-yl)methyl]piperidine (1/1)
| Molecular Formula | C25H29NO6 |
|---|---|
| Molecular Weight | 439.20 g/mol |
| LogP | 3.04 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.1995 |
| Heavy Atoms | 32 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 64036-57-3 |
|---|---|
| SMILES | C1CCN(CC1)CC2COC3(O2)C4=CC=CC=C4CCC5=CC=CC=C35.C(=O)(C(=O)O)O |
| InChIKey | BXARXSIGRZEVPJ-UHFFFAOYSA-N |
Product Overview
RefChem:380922 (CAS 64036-57-3), with molecular formula C25H29NO6 and molecular weight 439.20 g/mol. IUPAC: oxalic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)piperidine.
Chemical Property Profile of RefChem:380922
Property Insights of RefChem:380922
The XLogP value of 3.04 indicates that RefChem:380922 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:380922. Following Lipinski's Rule of Five, RefChem:380922 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 RefChem:380922?
The CAS number of RefChem:380922 is 64036-57-3.
What is the molecular formula of RefChem:380922?
The molecular formula of RefChem:380922 is C25H29NO6.
What is the molecular weight of RefChem:380922?
The molecular weight of RefChem:380922 is 439.20 g/mol.
Where can I buy RefChem:380922?
You can request a quote for RefChem:380922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:380922?
Yes, KEHONG BIO provides custom synthesis services for RefChem:380922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.