2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione
TL;DR: 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione (CAS 29753-32-0) is a chemical compound with molecular formula C12H7NO3 and molecular weight 213.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-benzo[g][3,1]benzoxazine-2,4-dione
Also Known As: 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione, 1h-naphtho[2,3-d][1,3]oxazine-2,4-dione, 1H,2H,4H-naphtho[2,3-d][1,3]oxazine-2,4-dione, 1H-benzo[g][3,1]benzoxazine-2,4-dione, 2H-Naphth[2,3-d][1,3]oxazine-2,4(1H)-dione
| Molecular Formula | C12H7NO3 |
|---|---|
| Molecular Weight | 213.04 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.04259 |
| Heavy Atoms | 16 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 29753-32-0 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C(=O)OC(=O)N3 |
| InChIKey | ZFOZSUKBPRAEMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione (CAS 29753-32-0), with molecular formula C12H7NO3 and molecular weight 213.04 g/mol. IUPAC: 1H-benzo[g][3,1]benzoxazine-2,4-dione.
Chemical Property Profile of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione
Property Insights of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione. With a topological polar surface area (TPSA) of 55.4 Ų, 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione 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
Frequently Asked Questions
What is the CAS number of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione?
The CAS number of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione is 29753-32-0.
What is the molecular formula of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione?
The molecular formula of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione is C12H7NO3.
What is the molecular weight of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione?
The molecular weight of 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione is 213.04 g/mol.
Where can I buy 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione?
You can request a quote for 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2H-naphtho[2,3-d][1,3]oxazine-2,4(1H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.