![4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione structure](/static/products/396/39674-97-0.png)
4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione
TL;DR: 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione (CAS 39674-97-0) is a chemical compound with molecular formula C14H11NO3 and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1H-benzo[g]indole-2,4,5-trione
Also Known As: 4-Hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione, 3,3-dimethyl-1H-benzo[g]indole-2,4,5-trione, BVT.948, >=98% (HPLC), solid, 4-Hydroxy-3,3-dimethyl-2H-benzo(g)indole-2,5(3H)-dione, RefChem:523777
| Molecular Formula | C14H11NO3 |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 1.3191 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 241.0739 |
| Heavy Atoms | 18 |
| Complexity | 652.7579 |
Chemical Identifiers
| CAS Number | 39674-97-0 |
|---|---|
| SMILES | CC1(C2=C(C3=CC=CC=C3C(=O)C2=O)NC1=O)C |
Product Overview
4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione (CAS 39674-97-0), with molecular formula C14H11NO3 and molecular weight 241.07 g/mol. IUPAC: 3,3-dimethyl-1H-benzo[g]indole-2,4,5-trione.
Chemical Property Profile of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione
Property Insights of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione
The XLogP value of 1.3191 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione. Following Lipinski's Rule of Five, 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-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 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione?
The CAS number of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione is 39674-97-0.
What is the molecular formula of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione?
The molecular formula of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione is C14H11NO3.
What is the molecular weight of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione?
The molecular weight of 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione is 241.07 g/mol.
Where can I buy 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione?
You can request a quote for 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-hydroxy-3,3-dimethyl-2H-benzo[g]indole-2,5(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.