RefChem:236805
TL;DR: RefChem:236805 (CAS 145594-59-8) is a chemical compound with molecular formula C15H10BrNO4 and molecular weight 346.9793 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(4-bromophenyl)-5,11-dioxa-2-azatricyclo[7.3.0.03,7]dodeca-1(9),3(7)-diene-6,10-dione
Also Known As: 1H,3H-Difuro(3,4-b:3',4'-e)pyridine-1,7(4H)-dione, 5,8-dihydro-8-(4-bromophenyl)-, 5,8-Dihydro-8-(4-bromophenyl)-1H,3H-difuro(3,4-b:3',4'-e)pyridine-1,7(4H)-dione, 3,8-Dihydro-8-(4-bromophenyl)-1H,5H-difuro[3,4-b:3 ,4 -e]pyridine-1,7(4H)-dione, 8-(4-Bromophenyl)-5,8-dihydro-1H,3H-difuro[3,4-b:3',4'-e]pyridine-1,7(4H)-dione, 8-(4-bromophenyl)-5,11-dioxa-2-azatricyclo[7.3.0.03,7]dodeca-1(9),3(7)-diene-6,10-dione
Technical Specifications
| Molecular Formula | C15H10BrNO4 |
| Molecular Weight | 346.9793 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.9793 Da |
| Heavy Atoms | 21 |
| Complexity | 546.0 |
| SMILES | C1C2=C(C(C3=C(N2)COC3=O)C4=CC=C(C=C4)Br)C(=O)O1 |
| InChIKey | ISAAROIPJLPBIT-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:236805
Property Insights of RefChem:236805
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:236805. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:236805. Following Lipinski's Rule of Five, RefChem:236805 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:236805?
The CAS number of RefChem:236805 is 145594-59-8.
What is the molecular formula of RefChem:236805?
The molecular formula of RefChem:236805 is C15H10BrNO4.
What is the molecular weight of RefChem:236805?
The molecular weight of RefChem:236805 is 346.9793 g/mol.
Where can I buy RefChem:236805?
You can request a quote for RefChem:236805 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:236805?
Yes, CoreyChem provides custom synthesis services for RefChem:236805 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.