6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one
TL;DR: 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one (CAS 433704-31-5) is a chemical compound with molecular formula C12H13BrN2O5 and molecular weight 344.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one
Also Known As: 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one, A3050/0128785, 6-(3-BROMO-4-HYDROXY-5-METHOXYPHENYL)-5-NITROTETRAHYDRO-2(1H)-PYRIDINONE
| Molecular Formula | C12H13BrN2O5 |
|---|---|
| Molecular Weight | 344.00 g/mol |
| LogP | 1.7597 |
| Topological Polar Surface Area | 101.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.0008 |
| Heavy Atoms | 20 |
| Complexity | 563.0238 |
Chemical Identifiers
| CAS Number | 433704-31-5 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C2C(CCC(=O)N2)[N+](=O)[O-])Br)O |
Product Overview
6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one (CAS 433704-31-5), with molecular formula C12H13BrN2O5 and molecular weight 344.00 g/mol. IUPAC: 6-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one.
Chemical Property Profile of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one
Property Insights of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one
The XLogP value of 1.7597 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one. The TPSA of 101.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one. Following Lipinski's Rule of Five, 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one 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 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one?
The CAS number of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one is 433704-31-5.
What is the molecular formula of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one?
The molecular formula of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one is C12H13BrN2O5.
What is the molecular weight of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one?
The molecular weight of 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one is 344.00 g/mol.
Where can I buy 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one?
You can request a quote for 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Bromo-4-hydroxy-5-methoxyphenyl)-5-nitropiperidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.