C28H22BrN3O5
TL;DR: C28H22BrN3O5 (CAS 1024359-49-6) is a chemical compound with molecular formula C28H22BrN3O5 and molecular weight 559.0743 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-bromophenyl)-1-(2-hydroxyphenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid
Also Known As: 1-((1H-indol-3-yl)methyl)-5-(4-bromophenyl)-3-(2-hydroxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid, 5-(4-bromophenyl)-1-(2-hydroxyphenyl)-3-(1H-indol-3-ylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid, 5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1-(1H-indol-3-ylmethyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid, C28H22BrN3O5
Technical Specifications
| Molecular Formula | C28H22BrN3O5 |
| Molecular Weight | 559.0743 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 559.0743 Da |
| Heavy Atoms | 37 |
| Complexity | 925.0 |
| SMILES | C1=CC=C(C(=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)C(N2)(CC5=CNC6=CC=CC=C65)C(=O)O)O |
| InChIKey | YHCPPBZNPZUVIH-UHFFFAOYSA-N |
Chemical Property Profile of C28H22BrN3O5
Property Insights of C28H22BrN3O5
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C28H22BrN3O5. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H22BrN3O5. Following Lipinski's Rule of Five, C28H22BrN3O5 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C28H22BrN3O5?
The CAS number of C28H22BrN3O5 is 1024359-49-6.
What is the molecular formula of C28H22BrN3O5?
The molecular formula of C28H22BrN3O5 is C28H22BrN3O5.
What is the molecular weight of C28H22BrN3O5?
The molecular weight of C28H22BrN3O5 is 559.0743 g/mol.
Where can I buy C28H22BrN3O5?
You can request a quote for C28H22BrN3O5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C28H22BrN3O5?
Yes, CoreyChem provides custom synthesis services for C28H22BrN3O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.