RefChem:1073270
TL;DR: RefChem:1073270 (CAS 84923-05-7) is a chemical compound with molecular formula C26H32N4O6 and molecular weight 496.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-methylpyrimidine-5-carboxamide;(E)-but-2-enedioic acid
Also Known As: N-(8-Benzyl-3-beta-nortropanyl)-4-ethoxy-2-methyl-5-pyrimidinecarboxamide fumarate, 5-Pyrimidinecarboxamide, N-(8-benzyl-3-beta-nortropanyl)-4-ethoxy-2-methyl-, monofumarate, N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-methylpyrimidine-5-carboxamide; (E)-but-2-enedioic acid, RefChem:1073270
| Molecular Formula | C26H32N4O6 |
|---|---|
| Molecular Weight | 496.23 g/mol |
| LogP | 2.82092 |
| Topological Polar Surface Area | 141.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 496.23218 |
| Heavy Atoms | 36 |
| Complexity | 1061.0969 |
Chemical Identifiers
| CAS Number | 84923-05-7 |
|---|---|
| SMILES | CCOC1=NC(=NC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1073270 (CAS 84923-05-7), with molecular formula C26H32N4O6 and molecular weight 496.23 g/mol. IUPAC: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-methylpyrimidine-5-carboxamide;(E)-but-2-enedioic acid.
Chemical Property Profile of RefChem:1073270
Property Insights of RefChem:1073270
The XLogP value of 2.82092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1073270. The TPSA of 141.95 Ų indicates high polarity, suggesting RefChem:1073270 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1073270 has 3 hydrogen bond donor(s) and 7 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 RefChem:1073270?
The CAS number of RefChem:1073270 is 84923-05-7.
What is the molecular formula of RefChem:1073270?
The molecular formula of RefChem:1073270 is C26H32N4O6.
What is the molecular weight of RefChem:1073270?
The molecular weight of RefChem:1073270 is 496.23 g/mol.
Where can I buy RefChem:1073270?
You can request a quote for RefChem:1073270 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073270?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073270 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.