ChemDiv1_009228
TL;DR: ChemDiv1_009228 (CAS 333404-95-8) is a chemical compound with molecular formula C28H25N3O3 and molecular weight 451.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[4-methoxy-3-(pyridin-2-yloxymethyl)phenyl]-1,2-dihydroquinazolin-4-one
Also Known As: ChemDiv1_009228, 3-benzyl-2-[4-methoxy-3-(pyridin-2-yloxymethyl)phenyl]-1,2-dihydroquinazolin-4-one, 3-benzyl-2-(4-methoxy-3-((pyridin-2-yloxy)methyl)phenyl)-2,3-dihydroquinazolin-4(1H)-one, 3-benzyl-2-{4-methoxy-3-[(2-pyridinyloxy)methyl]phenyl}-2,3-dihydro-4(1H)-quinazolinone, 3-benzyl-2-{4-methoxy-3-[(pyridin-2-yloxy)methyl]phenyl}-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C28H25N3O3 |
|---|---|
| Molecular Weight | 451.19 g/mol |
| LogP | 5.4359 |
| Topological Polar Surface Area | 63.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 451.1896 |
| Heavy Atoms | 34 |
| Complexity | 1278.5919 |
Chemical Identifiers
| CAS Number | 333404-95-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)COC5=CC=CC=N5 |
Product Overview
ChemDiv1_009228 (CAS 333404-95-8), with molecular formula C28H25N3O3 and molecular weight 451.19 g/mol. IUPAC: 3-benzyl-2-[4-methoxy-3-(pyridin-2-yloxymethyl)phenyl]-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of ChemDiv1_009228
Property Insights of ChemDiv1_009228
The XLogP value of 5.4359 indicates that ChemDiv1_009228 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.69 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009228. Following Lipinski's Rule of Five, ChemDiv1_009228 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_009228?
The CAS number of ChemDiv1_009228 is 333404-95-8.
What is the molecular formula of ChemDiv1_009228?
The molecular formula of ChemDiv1_009228 is C28H25N3O3.
What is the molecular weight of ChemDiv1_009228?
The molecular weight of ChemDiv1_009228 is 451.19 g/mol.
Where can I buy ChemDiv1_009228?
You can request a quote for ChemDiv1_009228 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009228?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009228 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.