1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride
TL;DR: 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride (CAS 19212-99-8) is a chemical compound with molecular formula C13H19ClN4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methylpiperidin-1-ium-1-yl)methyl]benzotriazole chloride
Also Known As: 1-((4-Methylpiperidino)methyl)benzotriazole hydrochloride, 1-[(4-methylpiperidin-1-ium-1-yl)methyl]benzotriazole chloride, 1H-BENZOTRIAZOLE, 1-((4-METHYLPIPERIDINO)METHYL)-, HYDROCHLORIDE, RefChem:237661
| Molecular Formula | C13H19ClN4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | -2.29 |
| Topological Polar Surface Area | 35.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.12982 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 19212-99-8 |
|---|---|
| SMILES | CC1CC[NH+](CC1)CN2C3=CC=CC=C3N=N2.[Cl-] |
| InChIKey | HVMPWRDRMTXHKD-UHFFFAOYSA-N |
Product Overview
1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride (CAS 19212-99-8), with molecular formula C13H19ClN4 and molecular weight 266.13 g/mol. IUPAC: 1-[(4-methylpiperidin-1-ium-1-yl)methyl]benzotriazole chloride.
Chemical Property Profile of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride
Property Insights of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride
The XLogP value of -2.29 indicates that 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.2 Ų, 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride 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 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride?
The CAS number of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride is 19212-99-8.
What is the molecular formula of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride?
The molecular formula of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride is C13H19ClN4.
What is the molecular weight of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride?
The molecular weight of 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride is 266.13 g/mol.
Where can I buy 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride?
You can request a quote for 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzotriazole, 1-((4-methylpiperidino)methyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.