ChemDiv1_022154
TL;DR: ChemDiv1_022154 (CAS 312946-41-1) is a chemical compound with molecular formula C29H29BrN2O4 and molecular weight 548.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-2-yl]-3-bromo-6,7,8,9-tetrahydrodibenzofuran-2-ol
Also Known As: ChemDiv1_022154, 1-[1,3-BIS(2-HYDROXYBENZYL)-2-IMIDAZOLIDINYL]-3-BROMO-6,7,8,9-TETRAHYDRODIBENZO[B,D]FURAN-2-OL, 1-[1,3-bis(2-hydroxybenzyl)imidazolidin-2-yl]-3-bromo-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol, 1-[1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-2-yl]-3-bromo-6,7,8,9-tetrahydrodibenzofuran-2-ol, 2,2'-((2-(3-bromo-2-hydroxy-6,7,8,9-tetrahydrodibenzo[b,d]furan-1-yl)imidazolidine-1,3-diyl)bis(methylene))diphenol
| Molecular Formula | C29H29BrN2O4 |
|---|---|
| Molecular Weight | 548.13 g/mol |
| LogP | 6.2075 |
| Topological Polar Surface Area | 80.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 548.13104 |
| Heavy Atoms | 36 |
| Complexity | 1377.0642 |
Chemical Identifiers
| CAS Number | 312946-41-1 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(C(=C(C=C3O2)Br)O)C4N(CCN4CC5=CC=CC=C5O)CC6=CC=CC=C6O |
Product Overview
ChemDiv1_022154 (CAS 312946-41-1), with molecular formula C29H29BrN2O4 and molecular weight 548.13 g/mol. IUPAC: 1-[1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-2-yl]-3-bromo-6,7,8,9-tetrahydrodibenzofuran-2-ol.
Chemical Property Profile of ChemDiv1_022154
Property Insights of ChemDiv1_022154
The XLogP value of 6.2075 indicates that ChemDiv1_022154 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.31 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022154. Following Lipinski's Rule of Five, ChemDiv1_022154 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022154?
The CAS number of ChemDiv1_022154 is 312946-41-1.
What is the molecular formula of ChemDiv1_022154?
The molecular formula of ChemDiv1_022154 is C29H29BrN2O4.
What is the molecular weight of ChemDiv1_022154?
The molecular weight of ChemDiv1_022154 is 548.13 g/mol.
Where can I buy ChemDiv1_022154?
You can request a quote for ChemDiv1_022154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022154?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.