C23H16Br2N2O4
TL;DR: C23H16Br2N2O4 (CAS 1022510-66-2) is a chemical compound with molecular formula C23H16Br2N2O4 and molecular weight 541.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-bromo-2-hydroxyphenyl)-5-(4-bromophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: 3-(5-bromo-2-hydroxyphenyl)-5-(4-bromophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 3-(5-bromo-2-hydroxyphenyl)-5-(4-bromophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, 3-(5-bromo-2-hydroxyphenyl)-5-(4-bromophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, C23H16Br2N2O4
| Molecular Formula | C23H16Br2N2O4 |
|---|---|
| Molecular Weight | 541.95 g/mol |
| LogP | 4.9683 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 541.9477 |
| Heavy Atoms | 31 |
| Complexity | 1169.9539 |
Chemical Identifiers
| CAS Number | 1022510-66-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)Br)C5=C(C=CC(=C5)Br)O |
Product Overview
C23H16Br2N2O4 (CAS 1022510-66-2), with molecular formula C23H16Br2N2O4 and molecular weight 541.95 g/mol. IUPAC: 3-(5-bromo-2-hydroxyphenyl)-5-(4-bromophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of C23H16Br2N2O4
Property Insights of C23H16Br2N2O4
The XLogP value of 4.9683 indicates that C23H16Br2N2O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for C23H16Br2N2O4. Following Lipinski's Rule of Five, C23H16Br2N2O4 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 C23H16Br2N2O4?
The CAS number of C23H16Br2N2O4 is 1022510-66-2.
What is the molecular formula of C23H16Br2N2O4?
The molecular formula of C23H16Br2N2O4 is C23H16Br2N2O4.
What is the molecular weight of C23H16Br2N2O4?
The molecular weight of C23H16Br2N2O4 is 541.95 g/mol.
Where can I buy C23H16Br2N2O4?
You can request a quote for C23H16Br2N2O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C23H16Br2N2O4?
Yes, KEHONG BIO provides custom synthesis services for C23H16Br2N2O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.