N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
TL;DR: N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide (CAS 893765-66-7) is a chemical compound with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
Also Known As: N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide, A4091/0174445, N-2-adamantyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide, 2H-1,4-Benzoxazine-6-carboxamide, 3,4-dihydro-3-oxo-N-tricyclo[3.3.1.1(3,7)]dec-2-yl-, 3-oxo-N-(tricyclo[3.3.1.1~3,7~]dec-2-yl)-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
| Molecular Formula | C19H22N2O3 |
|---|---|
| Molecular Weight | 326.16 g/mol |
| LogP | 2.572 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.16306 |
| Heavy Atoms | 24 |
| Complexity | 686.5635 |
Chemical Identifiers
| CAS Number | 893765-66-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)OCC(=O)N5 |
Product Overview
N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide (CAS 893765-66-7), with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol. IUPAC: N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide.
Chemical Property Profile of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
Property Insights of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide
The XLogP value of 2.572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide. Following Lipinski's Rule of Five, N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide 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 N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide?
The CAS number of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide is 893765-66-7.
What is the molecular formula of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide?
The molecular formula of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide is C19H22N2O3.
What is the molecular weight of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide?
The molecular weight of N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide is 326.16 g/mol.
Where can I buy N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide?
You can request a quote for N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-adamantyl)-3-oxo-4H-1,4-benzoxazine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.