2-(Dimethylamino)-4H-1,3-benzoxazin-4-one
TL;DR: 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one (CAS 776-70-5) is a chemical compound with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)-1,3-benzoxazin-4-one
Also Known As: 2-(dimethylamino)-1,3-benzoxazin-4-one, 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one, 2-N,N-dimethylamino-1,3-benzoxazin-4-one, J3.021.465J, 2-(Dimethylamino)-4H-1,3-benzooxazine-4-one
| Molecular Formula | C10H10N2O2 |
|---|---|
| Molecular Weight | 190.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.07423 |
| Heavy Atoms | 14 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 776-70-5 |
|---|---|
| SMILES | CN(C)C1=NC(=O)C2=CC=CC=C2O1 |
| InChIKey | FQZJDRFBCKJHTL-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)-4H-1,3-benzoxazin-4-one (CAS 776-70-5), with molecular formula C10H10N2O2 and molecular weight 190.07 g/mol. IUPAC: 2-(dimethylamino)-1,3-benzoxazin-4-one.
Chemical Property Profile of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one
Property Insights of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one. With a topological polar surface area (TPSA) of 41.9 Ų, 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one has 0 hydrogen bond donor(s) and 2 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-(Dimethylamino)-4H-1,3-benzoxazin-4-one?
The CAS number of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one is 776-70-5.
What is the molecular formula of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one?
The molecular formula of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one is C10H10N2O2.
What is the molecular weight of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one?
The molecular weight of 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one is 190.07 g/mol.
Where can I buy 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one?
You can request a quote for 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)-4H-1,3-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.