2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione
TL;DR: 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione (CAS 184474-91-7) is a chemical compound with molecular formula C14H9BrN2O2 and molecular weight 315.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-bromophenyl)-2H-phthalazine-1,4-dione
Also Known As: 3-(2-bromophenyl)-2H-phthalazine-1,4-dione, 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione, 2,3-dihydro-5-allyloxy-6-bromobenzofuran, Phthalazine-1,4(2H,3H)-dione, 2-(2-bromophenyl)-, 2-(2-Bromophenyl)-2,3-dihydrophthalazine-1,4-dione
| Molecular Formula | C14H9BrN2O2 |
|---|---|
| Molecular Weight | 315.98 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.98474 |
| Heavy Atoms | 19 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 184474-91-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC=CC=C3Br |
| InChIKey | BOZWMMOWVLOHJZ-UHFFFAOYSA-N |
Product Overview
2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione (CAS 184474-91-7), with molecular formula C14H9BrN2O2 and molecular weight 315.98 g/mol. IUPAC: 3-(2-bromophenyl)-2H-phthalazine-1,4-dione.
Chemical Property Profile of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione
Property Insights of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione. With a topological polar surface area (TPSA) of 49.4 Ų, 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione has 1 hydrogen bond donor(s) and 2 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 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione?
The CAS number of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione is 184474-91-7.
What is the molecular formula of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione?
The molecular formula of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione is C14H9BrN2O2.
What is the molecular weight of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione?
The molecular weight of 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione is 315.98 g/mol.
Where can I buy 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione?
You can request a quote for 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Bromophenyl)-2,3-dihydro-1,4-phthalazinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.