2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride
TL;DR: 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride (CAS 59384-74-6) is a chemical compound with molecular formula C13H17ClN2O3 and molecular weight 284.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-oxopropyl]azanium chloride
Also Known As: 6-(3-(Dimethylamino)propionyl)-3-methyl-2-benzoxazolinone hydrochloride, 2-BENZOXAZOLINONE, 6-(3-(DIMETHYLAMINO)PROPIONYL)-3-METHYL-, HYDROCHLORIDE, 2(3H)-Benzoxazolone, 6-[3-(dimethylamino)-1-oxopropyl]-3-methyl-, monohydrochloride, dimethyl-[3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-oxopropyl]azanium chloride, RefChem:256437
| Molecular Formula | C13H17ClN2O3 |
|---|---|
| Molecular Weight | 284.09 g/mol |
| LogP | -3.15 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.09277 |
| Heavy Atoms | 19 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 59384-74-6 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)C(=O)CC[NH+](C)C)OC1=O.[Cl-] |
| InChIKey | GATWNCNVJZQPCR-UHFFFAOYSA-N |
Product Overview
2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride (CAS 59384-74-6), with molecular formula C13H17ClN2O3 and molecular weight 284.09 g/mol. IUPAC: dimethyl-[3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-3-oxopropyl]azanium chloride.
Chemical Property Profile of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride
Property Insights of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride
The XLogP value of -3.15 indicates that 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.1 Ų, 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride has 1 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 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride?
The CAS number of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride is 59384-74-6.
What is the molecular formula of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride?
The molecular formula of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride is C13H17ClN2O3.
What is the molecular weight of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride?
The molecular weight of 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride is 284.09 g/mol.
Where can I buy 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride?
You can request a quote for 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoxazolinone, 6-(3-(dimethylamino)propionyl)-3-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.