MixCom6_001863
TL;DR: MixCom6_001863 (CAS 333394-90-4) is a chemical compound with molecular formula C25H18N2O4 and molecular weight 410.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenyl)-5-(8-methyl-4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione
Also Known As: MixCom6_001863, BIM-0032165.P001, 2-(3,4-dimethylphenyl)-5-(8-methyl-4-oxo-4H-3,1-benzoxazin-2-yl)-1H-isoindole-1,3(2H)-dione, AB00096089-01, 2-(3,4-dimethylphenyl)-5-(8-methyl-4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione
| Molecular Formula | C25H18N2O4 |
|---|---|
| Molecular Weight | 410.13 g/mol |
| LogP | 4.58086 |
| Topological Polar Surface Area | 80.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 410.12665 |
| Heavy Atoms | 31 |
| Complexity | 1483.1252 |
Chemical Identifiers
| CAS Number | 333394-90-4 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=O)OC(=N2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=C(C=C5)C)C |
Product Overview
MixCom6_001863 (CAS 333394-90-4), with molecular formula C25H18N2O4 and molecular weight 410.13 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-5-(8-methyl-4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione.
Chemical Property Profile of MixCom6_001863
Property Insights of MixCom6_001863
The XLogP value of 4.58086 indicates that MixCom6_001863 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.48 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_001863. Following Lipinski's Rule of Five, MixCom6_001863 has 0 hydrogen bond donor(s) and 5 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 MixCom6_001863?
The CAS number of MixCom6_001863 is 333394-90-4.
What is the molecular formula of MixCom6_001863?
The molecular formula of MixCom6_001863 is C25H18N2O4.
What is the molecular weight of MixCom6_001863?
The molecular weight of MixCom6_001863 is 410.13 g/mol.
Where can I buy MixCom6_001863?
You can request a quote for MixCom6_001863 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_001863?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_001863 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.