6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione
TL;DR: 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione (CAS 4297-75-0) is a chemical compound with molecular formula C8H6N2O3 and molecular weight 178.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-1,3-benzoxazine-2,4-dione
Also Known As: 6-amino-1,3-benzoxazine-2,4-dione, 6-amino-2h-1,3-benzoxazine-2,4(3h)-dione, 6-AMINO-3,4-DIHYDRO-2H-1,3-BENZOXAZINE-2,4-DIONE, 6-Aminodihydro-1.3-benzoxazin-2.4-dion, 4-amino-10-oxa-8-azabicyclo[4.4.0]deca-2,4,11-triene-7,9-dione
| Molecular Formula | C8H6N2O3 |
|---|---|
| Molecular Weight | 178.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.03784 |
| Heavy Atoms | 13 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 4297-75-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1N)C(=O)NC(=O)O2 |
| InChIKey | OQBHIDQYRBFXNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione (CAS 4297-75-0), with molecular formula C8H6N2O3 and molecular weight 178.04 g/mol. IUPAC: 6-amino-1,3-benzoxazine-2,4-dione.
Chemical Property Profile of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione
Property Insights of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione. Following Lipinski's Rule of Five, 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione has 2 hydrogen bond donor(s) and 4 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 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione?
The CAS number of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione is 4297-75-0.
What is the molecular formula of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione?
The molecular formula of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione is C8H6N2O3.
What is the molecular weight of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione?
The molecular weight of 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione is 178.04 g/mol.
Where can I buy 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione?
You can request a quote for 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-3,4-dihydro-2H-1,3-benzoxazine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.