UPCMLD0ENAT0517-3958:001
TL;DR: UPCMLD0ENAT0517-3958:001 (CAS 5851-71-8) 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)-2-(2-methylphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: UPCMLD0ENAT0517-3958:001, AF-399/12857040, 3-(2-furyl)-2-(2-methylphenyl)-5-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione, 3-(furan-2-yl)-2-(2-methylphenyl)-5-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, F1065-0431
| 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 | 5851-71-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=CO5 |
Product Overview
UPCMLD0ENAT0517-3958:001 (CAS 5851-71-8), with molecular formula C22H18N2O4 and molecular weight 374.13 g/mol. IUPAC: 3-(furan-2-yl)-2-(2-methylphenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of UPCMLD0ENAT0517-3958:001
Property Insights of UPCMLD0ENAT0517-3958:001
The XLogP value of 3.63912 indicates that UPCMLD0ENAT0517-3958:001 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 UPCMLD0ENAT0517-3958:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0517-3958:001 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 UPCMLD0ENAT0517-3958:001?
The CAS number of UPCMLD0ENAT0517-3958:001 is 5851-71-8.
What is the molecular formula of UPCMLD0ENAT0517-3958:001?
The molecular formula of UPCMLD0ENAT0517-3958:001 is C22H18N2O4.
What is the molecular weight of UPCMLD0ENAT0517-3958:001?
The molecular weight of UPCMLD0ENAT0517-3958:001 is 374.13 g/mol.
Where can I buy UPCMLD0ENAT0517-3958:001?
You can request a quote for UPCMLD0ENAT0517-3958:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0517-3958:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0517-3958:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.