C19H13FN2O5
TL;DR: C19H13FN2O5 (CAS 1212096-05-3) is a chemical compound with molecular formula C19H13FN2O5 and molecular weight 368.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3aR,6aS)-3-(4-fluorophenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate
Also Known As: 4-((3aR,6aS)-3-(4-fluorophenyl)-4,6-dioxo-6,6a-dihydro-3aH-pyrrolo[3,4-d]isoxazol-5(4H)-yl)phenyl acetate
| Molecular Formula | C19H13FN2O5 |
|---|---|
| Molecular Weight | 368.08 g/mol |
| LogP | 2.0435 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.08084 |
| Heavy Atoms | 27 |
| Complexity | 968.5995 |
Chemical Identifiers
| CAS Number | 1212096-05-3 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)N2C(=O)[C@H]3[C@@H](C2=O)ON=C3C4=CC=C(C=C4)F |
Product Overview
C19H13FN2O5 (CAS 1212096-05-3), with molecular formula C19H13FN2O5 and molecular weight 368.08 g/mol. IUPAC: [4-[(3aR,6aS)-3-(4-fluorophenyl)-4,6-dioxo-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazol-5-yl]phenyl] acetate.
Chemical Property Profile of C19H13FN2O5
Property Insights of C19H13FN2O5
The XLogP value of 2.0435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C19H13FN2O5. The TPSA of 85.27 Ų falls within the moderate polarity range, balancing permeability and solubility for C19H13FN2O5. Following Lipinski's Rule of Five, C19H13FN2O5 has 0 hydrogen bond donor(s) and 6 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 C19H13FN2O5?
The CAS number of C19H13FN2O5 is 1212096-05-3.
What is the molecular formula of C19H13FN2O5?
The molecular formula of C19H13FN2O5 is C19H13FN2O5.
What is the molecular weight of C19H13FN2O5?
The molecular weight of C19H13FN2O5 is 368.08 g/mol.
Where can I buy C19H13FN2O5?
You can request a quote for C19H13FN2O5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H13FN2O5?
Yes, KEHONG BIO provides custom synthesis services for C19H13FN2O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.