7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide
TL;DR: 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide (CAS 39322-04-8) is a chemical compound with molecular formula C11H11ClN2O3 and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-N,N-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide
Also Known As: 3,4-Dihydro-1-chloro-N,N-dimethyl-3-oxo-2H-1,4-benzoxazine-2-carboxamide, 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide, 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-1-chloro-N,N-dimethyl-3-oxo-, 7-chloro-n,n-dimethyl-3-oxo-3,4-dihydro-2h-1,4-benzoxazine-2-carboxamide, 7-chloro-N,N-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide
| Molecular Formula | C11H11ClN2O3 |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.04582 |
| Heavy Atoms | 17 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 39322-04-8 |
|---|---|
| SMILES | CN(C)C(=O)C1C(=O)NC2=C(O1)C=C(C=C2)Cl |
| InChIKey | KMBGCOAEYJJZNQ-UHFFFAOYSA-N |
Product Overview
7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide (CAS 39322-04-8), with molecular formula C11H11ClN2O3 and molecular weight 254.05 g/mol. IUPAC: 7-chloro-N,N-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide.
Chemical Property Profile of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide
Property Insights of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide. With a topological polar surface area (TPSA) of 58.6 Ų, 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide 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 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide?
The CAS number of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide is 39322-04-8.
What is the molecular formula of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide?
The molecular formula of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide is C11H11ClN2O3.
What is the molecular weight of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide?
The molecular weight of 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide is 254.05 g/mol.
Where can I buy 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide?
You can request a quote for 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-3-hydroxy-N,N-dimethyl-2H-1,4-benzoxazine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.