N1-2'-溴乙基二氢烟酰胺
TL;DR: N1-2'-溴乙基二氢烟酰胺 (CAS 64037-99-6) is a chemical compound with molecular formula C8H11BrN2O and molecular weight 230.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N1-2'-溴乙基二氢烟酰胺
N-(2-bromoethyl)-1,2-dihydropyridine-3-carboxamide
Also Known As: N(sup 1)-2'-Bromoethyldihydronicotinamide, Nicotinamide, N(sup 1)-2'-bromoethyldihydro-, n-(2-bromoethyl)-1,2-dihydropyridine-3-carboxamide, 3-Pyridinecarboxamide,1-(2-bromoethyl)-1,2-dihydro-, RefChem:1092375
| Molecular Formula | C8H11BrN2O |
|---|---|
| Molecular Weight | 230.01 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.00548 |
| Heavy Atoms | 12 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 64037-99-6 |
|---|---|
| SMILES | C1C(=CC=CN1)C(=O)NCCBr |
| InChIKey | KJGGXIOQJLNOGL-UHFFFAOYSA-N |
Product Overview
N1-2'-溴乙基二氢烟酰胺 (CAS 64037-99-6), with molecular formula C8H11BrN2O and molecular weight 230.01 g/mol. IUPAC: N-(2-bromoethyl)-1,2-dihydropyridine-3-carboxamide.
Chemical Property Profile of N1-2'-溴乙基二氢烟酰胺
Property Insights of N1-2'-溴乙基二氢烟酰胺
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-2'-溴乙基二氢烟酰胺. With a topological polar surface area (TPSA) of 41.1 Ų, N1-2'-溴乙基二氢烟酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-2'-溴乙基二氢烟酰胺 has 2 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 N1-2'-溴乙基二氢烟酰胺?
The CAS number of N1-2'-溴乙基二氢烟酰胺 is 64037-99-6.
What is the molecular formula of N1-2'-溴乙基二氢烟酰胺?
The molecular formula of N1-2'-溴乙基二氢烟酰胺 is C8H11BrN2O.
What is the molecular weight of N1-2'-溴乙基二氢烟酰胺?
The molecular weight of N1-2'-溴乙基二氢烟酰胺 is 230.01 g/mol.
Where can I buy N1-2'-溴乙基二氢烟酰胺?
You can request a quote for N1-2'-溴乙基二氢烟酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-2'-溴乙基二氢烟酰胺?
Yes, KEHONG BIO provides custom synthesis services for N1-2'-溴乙基二氢烟酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.