![2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione structure](/static/products/5229/5229-09-4.webp)
2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione
TL;DR: 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione (CAS 5229-09-4) is a chemical compound with molecular formula C18H17BrN2O3 and molecular weight 388.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-6-hydroxy-5,6-dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),10,12,14,16-pentaene-2,9-dione
Also Known As: 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 5-Bromo-6-hydroxy-5,6-dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),10,12,14,16-pentaene-2,9-dione, Benzo[g]pyridazino[1,2-b]phthalazine-6,13-dione, 2-bromo-1,2,3,4-tetrahydro-3-hydroxy-2,3-dimethyl-
| Molecular Formula | C18H17BrN2O3 |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 388.04224 |
| Heavy Atoms | 24 |
| Complexity | 585.0 |
Chemical Identifiers
| CAS Number | 5229-09-4 |
|---|---|
| SMILES | CC1(CN2C(=O)C3=CC4=CC=CC=C4C=C3C(=O)N2CC1(C)Br)O |
| InChIKey | KGMIMYPAHWYCTK-UHFFFAOYSA-N |
Product Overview
2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione (CAS 5229-09-4), with molecular formula C18H17BrN2O3 and molecular weight 388.04 g/mol. IUPAC: 5-bromo-6-hydroxy-5,6-dimethyl-3,8-diazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),10,12,14,16-pentaene-2,9-dione.
Chemical Property Profile of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione
Property Insights of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione. Following Lipinski's Rule of Five, 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione has 1 hydrogen bond donor(s) and 3 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-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione?
The CAS number of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione is 5229-09-4.
What is the molecular formula of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione?
The molecular formula of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione is C18H17BrN2O3.
What is the molecular weight of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione?
The molecular weight of 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione is 388.04 g/mol.
Where can I buy 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione?
You can request a quote for 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-3-hydroxy-2,3-dimethyl-1,2,3,4-tetrahydrobenzo[g]pyridazino[1,2-b]phthalazine-6,13-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.