NCI60_027722
TL;DR: NCI60_027722 (CAS 144898-53-3) is a chemical compound with molecular formula C42H47NO8 and molecular weight 693.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2,6-dioxo-4-[1,2,3,4-tetrakis(phenylmethoxy)butyl]piperidine-3-carboxylate
Also Known As: NCI60_027722, NCI60_027725, 1,1-Dimethylethyl 2,6-dioxo-4-[1,2,3,4-tetrakis(phenylmethoxy)butyl]-3-piperidinecarboxylate, tert-butyl 2,6-dioxo-4-[1,2,3,4-tetrakis(benzyloxy)butyl]piperidine-3-carboxylate, tert-butyl 2,6-dioxo-4-[1,2,3,4-tetrakis(phenylmethoxy)butyl]piperidine-3-carboxylate
| Molecular Formula | C42H47NO8 |
|---|---|
| Molecular Weight | 693.33 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 19 |
| Exact Mass | 693.33014 |
| Heavy Atoms | 51 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 144898-53-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)C1C(CC(=O)NC1=O)C(C(C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5 |
| InChIKey | ATIZHXQUOYPBJB-UHFFFAOYSA-N |
Product Overview
NCI60_027722 (CAS 144898-53-3), with molecular formula C42H47NO8 and molecular weight 693.33 g/mol. IUPAC: tert-butyl 2,6-dioxo-4-[1,2,3,4-tetrakis(phenylmethoxy)butyl]piperidine-3-carboxylate.
Chemical Property Profile of NCI60_027722
Property Insights of NCI60_027722
The XLogP value of 5.9 indicates that NCI60_027722 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_027722. Following Lipinski's Rule of Five, NCI60_027722 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_027722?
The CAS number of NCI60_027722 is 144898-53-3.
What is the molecular formula of NCI60_027722?
The molecular formula of NCI60_027722 is C42H47NO8.
What is the molecular weight of NCI60_027722?
The molecular weight of NCI60_027722 is 693.33 g/mol.
Where can I buy NCI60_027722?
You can request a quote for NCI60_027722 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_027722?
Yes, KEHONG BIO provides custom synthesis services for NCI60_027722 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.