6-amino-3-propyl-2H-1,3-benzoxazin-4-one
TL;DR: 6-amino-3-propyl-2H-1,3-benzoxazin-4-one (CAS 46393-54-8) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-3-propyl-2H-1,3-benzoxazin-4-one
Also Known As: 6-amino-3-propyl-2H-1,3-benzoxazin-4-one, 6-amino-3-propyl-2,3-dihydro-benzo[e][1,3]oxazin-4-one, 6-amino-3-propyl-2,3-dihydro-4h-1,3-benzoxazin-4-one, 3-amino-9-propyl-7-oxa-9-azabicyclo[4.4.0]deca-2,4,11-trien-10-one
Technical Specifications
| Molecular Formula | C11H14N2O2 |
| Molecular Weight | 206.10553 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.10553 Da |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
| SMILES | CCCN1COC2=C(C1=O)C=C(C=C2)N |
| InChIKey | IRVGNBUXXSJNJW-UHFFFAOYSA-N |
Chemical Property Profile of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one
Property Insights of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-3-propyl-2H-1,3-benzoxazin-4-one. With a topological polar surface area (TPSA) of 55.6 Ų, 6-amino-3-propyl-2H-1,3-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-amino-3-propyl-2H-1,3-benzoxazin-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one?
The CAS number of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one is 46393-54-8.
What is the molecular formula of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one?
The molecular formula of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one is C11H14N2O2.
What is the molecular weight of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one?
The molecular weight of 6-amino-3-propyl-2H-1,3-benzoxazin-4-one is 206.10553 g/mol.
Where can I buy 6-amino-3-propyl-2H-1,3-benzoxazin-4-one?
You can request a quote for 6-amino-3-propyl-2H-1,3-benzoxazin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-amino-3-propyl-2H-1,3-benzoxazin-4-one?
Yes, CoreyChem provides custom synthesis services for 6-amino-3-propyl-2H-1,3-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.