ChemDiv3_004174
TL;DR: ChemDiv3_004174 (CAS 472993-64-9) is a chemical compound with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-1-(pyridin-4-ylmethyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-ol
Also Known As: ChemDiv3_004174, IDI1_022084, AE-848/11419059, BRD-K61385077-001-01-2, 3-tert-butyl-1-[(pyridin-4-ylmethylamino)methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one
| Molecular Formula | C23H26N2O2 |
|---|---|
| Molecular Weight | 362.20 g/mol |
| LogP | 5.3288 |
| Topological Polar Surface Area | 58.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.19943 |
| Heavy Atoms | 27 |
| Complexity | 994.8756 |
Chemical Identifiers
| CAS Number | 472993-64-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C3=C(O2)CCCC3)C(=C1O)C=NCC4=CC=NC=C4 |
Product Overview
ChemDiv3_004174 (CAS 472993-64-9), with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol. IUPAC: 3-tert-butyl-1-(pyridin-4-ylmethyliminomethyl)-6,7,8,9-tetrahydrodibenzofuran-2-ol.
Chemical Property Profile of ChemDiv3_004174
Property Insights of ChemDiv3_004174
The XLogP value of 5.3288 indicates that ChemDiv3_004174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.62 Ų, ChemDiv3_004174 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_004174 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_004174?
The CAS number of ChemDiv3_004174 is 472993-64-9.
What is the molecular formula of ChemDiv3_004174?
The molecular formula of ChemDiv3_004174 is C23H26N2O2.
What is the molecular weight of ChemDiv3_004174?
The molecular weight of ChemDiv3_004174 is 362.20 g/mol.
Where can I buy ChemDiv3_004174?
You can request a quote for ChemDiv3_004174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004174?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.