Isopropyl 5-bromonicotinamide
TL;DR: Isopropyl 5-bromonicotinamide (CAS 104290-45-1) is a chemical compound with molecular formula C9H11BrN2O and molecular weight 242.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-propan-2-ylpyridine-3-carboxamide
Also Known As: ISOPROPYL 5-BROMONICOTINAMIDE, 5-Bromo-N-isopropylnicotinamide, 5-bromo-N-propan-2-ylpyridine-3-carboxamide, 5-bromo-N-(propan-2-yl)pyridine-3-carboxamide, 5-bromo-N-isopropyl-pyridine-3-carboxamide
| Molecular Formula | C9H11BrN2O |
|---|---|
| Molecular Weight | 242.01 g/mol |
| LogP | 1.9823 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.00548 |
| Heavy Atoms | 13 |
| Complexity | 312.23795 |
Chemical Identifiers
| CAS Number | 104290-45-1 |
|---|---|
| SMILES | CC(C)NC(=O)C1=CC(=CN=C1)Br |
Product Overview
Isopropyl 5-bromonicotinamide (CAS 104290-45-1), with molecular formula C9H11BrN2O and molecular weight 242.01 g/mol. IUPAC: 5-bromo-N-propan-2-ylpyridine-3-carboxamide.
Chemical Property Profile of Isopropyl 5-bromonicotinamide
Property Insights of Isopropyl 5-bromonicotinamide
The XLogP value of 1.9823 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 5-bromonicotinamide. With a topological polar surface area (TPSA) of 41.99 Ų, Isopropyl 5-bromonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl 5-bromonicotinamide has 1 hydrogen bond donor(s) and 2 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 Isopropyl 5-bromonicotinamide?
The CAS number of Isopropyl 5-bromonicotinamide is 104290-45-1.
What is the molecular formula of Isopropyl 5-bromonicotinamide?
The molecular formula of Isopropyl 5-bromonicotinamide is C9H11BrN2O.
What is the molecular weight of Isopropyl 5-bromonicotinamide?
The molecular weight of Isopropyl 5-bromonicotinamide is 242.01 g/mol.
Where can I buy Isopropyl 5-bromonicotinamide?
You can request a quote for Isopropyl 5-bromonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 5-bromonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 5-bromonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.