ChemDiv2_004223
TL;DR: ChemDiv2_004223 (CAS 1005052-41-4) is a chemical compound with molecular formula C22H18N2O4 and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-5-(3-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: ChemDiv2_004223, IDI1_002938, 3-(furan-2-yl)-2-phenyl-5-(m-tolyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, F1248-0015, 3-(furan-2-yl)-5-(3-methylphenyl)-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C22H18N2O4 |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 3.63912 |
| Topological Polar Surface Area | 62.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.12665 |
| Heavy Atoms | 28 |
| Complexity | 1031.71 |
Chemical Identifiers
| CAS Number | 1005052-41-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=CO5 |
Product Overview
ChemDiv2_004223 (CAS 1005052-41-4), with molecular formula C22H18N2O4 and molecular weight 374.13 g/mol. IUPAC: 3-(furan-2-yl)-5-(3-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of ChemDiv2_004223
Property Insights of ChemDiv2_004223
The XLogP value of 3.63912 indicates that ChemDiv2_004223 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004223. Following Lipinski's Rule of Five, ChemDiv2_004223 has 0 hydrogen bond donor(s) and 5 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 ChemDiv2_004223?
The CAS number of ChemDiv2_004223 is 1005052-41-4.
What is the molecular formula of ChemDiv2_004223?
The molecular formula of ChemDiv2_004223 is C22H18N2O4.
What is the molecular weight of ChemDiv2_004223?
The molecular weight of ChemDiv2_004223 is 374.13 g/mol.
Where can I buy ChemDiv2_004223?
You can request a quote for ChemDiv2_004223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004223?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.