2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride
TL;DR: 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride (CAS 22244-25-3) is a chemical compound with molecular formula C13H19ClN2O2 and molecular weight 270.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl(3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl)azanium chloride
Also Known As: 3,4-Dihydro-N-butyl-2H-1,4-benzoxazine-2-carboxamide hydrochloride, 2H-1,4-BENZOXAZINE-2-CARBOXAMIDE, 3,4-DIHYDRO-N-BUTYL-, MONOHYDROCHLORIDE, butyl(3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl)azanium chloride, RefChem:1065144
| Molecular Formula | C13H19ClN2O2 |
|---|---|
| Molecular Weight | 270.11 g/mol |
| LogP | -2.25 |
| Topological Polar Surface Area | 54.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.1135 |
| Heavy Atoms | 18 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 22244-25-3 |
|---|---|
| SMILES | CCCC[NH2+]C(=O)C1CNC2=CC=CC=C2O1.[Cl-] |
| InChIKey | NJXVAEPBUNMXTK-UHFFFAOYSA-N |
Product Overview
2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride (CAS 22244-25-3), with molecular formula C13H19ClN2O2 and molecular weight 270.11 g/mol. IUPAC: butyl(3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl)azanium chloride.
Chemical Property Profile of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride
Property Insights of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride
The XLogP value of -2.25 indicates that 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.9 Ų, 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride has 2 hydrogen bond donor(s) and 4 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-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride?
The CAS number of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride is 22244-25-3.
What is the molecular formula of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride?
The molecular formula of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride is C13H19ClN2O2.
What is the molecular weight of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride?
The molecular weight of 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride is 270.11 g/mol.
Where can I buy 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride?
You can request a quote for 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.