6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one
TL;DR: 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one (CAS 105202-25-3) is a chemical compound with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4H-1,4-benzoxazin-3-one
Also Known As: 6-amino-2H-1,4-benzoxazin-3(4H)-one, 6-amino-4H-1,4-benzoxazin-3-one, 6-amino-2H-benzo[b][1,4]oxazin-3(4H)-one, 6-Amino-2H-1,4-benzoxin-3(4H)-one, 6-amino-2,4-dihydro-1,4-benzoxazin-3-one
| Molecular Formula | C8H8N2O2 |
|---|---|
| Molecular Weight | 164.06 g/mol |
| LogP | 0.5997 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.05858 |
| Heavy Atoms | 12 |
| Complexity | 335.82977 |
Chemical Identifiers
| CAS Number | 105202-25-3 |
|---|---|
| SMILES | C1C(=O)NC2=C(O1)C=CC(=C2)N |
Product Overview
6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one (CAS 105202-25-3), with molecular formula C8H8N2O2 and molecular weight 164.06 g/mol. IUPAC: 6-amino-4H-1,4-benzoxazin-3-one.
Chemical Property Profile of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one
Property Insights of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one
The XLogP value of 0.5997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one. Following Lipinski's Rule of Five, 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one has 2 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 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one?
The CAS number of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one is 105202-25-3.
What is the molecular formula of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one?
The molecular formula of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one is C8H8N2O2.
What is the molecular weight of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one?
The molecular weight of 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one is 164.06 g/mol.
Where can I buy 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one?
You can request a quote for 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one 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-1,4-benzoxazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-3,4-dihydro-2H-1,4-benzoxazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.