ChemDiv1_019572
TL;DR: ChemDiv1_019572 (CAS 312605-63-3) is a chemical compound with molecular formula C24H19FN2O3 and molecular weight 402.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-3-(4-fluorophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: ChemDiv1_019572, BAS 00786958, UPCMLD0ENAT0501-2264:001, 5-benzyl-3-(4-fluorophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, AB00080791-01
| Molecular Formula | C24H19FN2O3 |
|---|---|
| Molecular Weight | 402.14 g/mol |
| LogP | 3.8724 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.13797 |
| Heavy Atoms | 30 |
| Complexity | 1072.6248 |
Chemical Identifiers
| CAS Number | 312605-63-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)F |
Product Overview
ChemDiv1_019572 (CAS 312605-63-3), with molecular formula C24H19FN2O3 and molecular weight 402.14 g/mol. IUPAC: 5-benzyl-3-(4-fluorophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of ChemDiv1_019572
Property Insights of ChemDiv1_019572
The XLogP value of 3.8724 indicates that ChemDiv1_019572 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, ChemDiv1_019572 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_019572 has 0 hydrogen bond donor(s) and 4 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 ChemDiv1_019572?
The CAS number of ChemDiv1_019572 is 312605-63-3.
What is the molecular formula of ChemDiv1_019572?
The molecular formula of ChemDiv1_019572 is C24H19FN2O3.
What is the molecular weight of ChemDiv1_019572?
The molecular weight of ChemDiv1_019572 is 402.14 g/mol.
Where can I buy ChemDiv1_019572?
You can request a quote for ChemDiv1_019572 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019572?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019572 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.