2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione
TL;DR: 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione (CAS 2130-57-6) is a chemical compound with molecular formula C18H12N2O4 and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-6-(2-methyl-4-oxo-3,1-benzoxazin-6-yl)-3,1-benzoxazin-4-one
Also Known As: BAS 00132784, 6,6'-Bis(2-methylbenz[d][1,3]oxazin-4-one), 2,2'-Dimethyl[6,6'-bi-4H-3,1-benzoxazine]-4,4'-dione, 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione, 2,2'-Dimethyl-[6,6']bi[benzo[d][1,3]oxazinyl]-4,4'-dione
| Molecular Formula | C18H12N2O4 |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 77.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.0797 |
| Heavy Atoms | 24 |
| Complexity | 573.0 |
Chemical Identifiers
| CAS Number | 2130-57-6 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)C3=CC4=C(C=C3)N=C(OC4=O)C)C(=O)O1 |
| InChIKey | QOAAZOVWOPMNGS-UHFFFAOYSA-N |
Product Overview
2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione (CAS 2130-57-6), with molecular formula C18H12N2O4 and molecular weight 320.08 g/mol. IUPAC: 2-methyl-6-(2-methyl-4-oxo-3,1-benzoxazin-6-yl)-3,1-benzoxazin-4-one.
Chemical Property Profile of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione
Property Insights of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione. Following Lipinski's Rule of Five, 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione has 0 hydrogen bond donor(s) and 6 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'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione?
The CAS number of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione is 2130-57-6.
What is the molecular formula of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione?
The molecular formula of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione is C18H12N2O4.
What is the molecular weight of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione?
The molecular weight of 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione is 320.08 g/mol.
Where can I buy 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione?
You can request a quote for 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Dimethyl(6,6'-bi-4H-3,1-benzoxazine)-4,4'-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.