Ncq 469
TL;DR: Ncq 469 (CAS 101460-47-3) is a chemical compound with molecular formula C16H23BrN2O4 and molecular weight 386.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-hydroxy-2,6-dimethoxybenzamide
Also Known As: Ncq 469, 3-Bromo-N-((1-ethyl-2-pyrrolidinyl)-methyl)-5-hydroxy-2,6-dimethoxybenzamide hydrochloride, 3-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-hydroxy-2,6-dimethoxybenzamide, 3-bromo-5-hydroxy-2,6-dimethoxybenzoic acid, 3-Bromo-N-[(1-ethyl-2-pyrrolidinyl)methyl]-5-hydroxy-2,6-dimethoxybenzamide
| Molecular Formula | C16H23BrN2O4 |
|---|---|
| Molecular Weight | 386.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.0841 |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 101460-47-3 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Br)O)OC |
| InChIKey | NLIPZVMIMUCCIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ncq 469 (CAS 101460-47-3), with molecular formula C16H23BrN2O4 and molecular weight 386.08 g/mol. IUPAC: 3-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-hydroxy-2,6-dimethoxybenzamide.
Chemical Property Profile of Ncq 469
Property Insights of Ncq 469
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ncq 469. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ncq 469. Following Lipinski's Rule of Five, Ncq 469 has 2 hydrogen bond donor(s) and 5 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 Ncq 469?
The CAS number of Ncq 469 is 101460-47-3.
What is the molecular formula of Ncq 469?
The molecular formula of Ncq 469 is C16H23BrN2O4.
What is the molecular weight of Ncq 469?
The molecular weight of Ncq 469 is 386.08 g/mol.
Where can I buy Ncq 469?
You can request a quote for Ncq 469 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ncq 469?
Yes, KEHONG BIO provides custom synthesis services for Ncq 469 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.