1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-
TL;DR: 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- (CAS 110216-32-5) is a chemical compound with molecular formula C17H22ClN5OS and molecular weight 379.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-2-[3-(4-methylpiperazin-1-yl)propyl]-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one
Also Known As: 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-, 7-Chloro-2-[3-(4-methylpiperazin-1-yl)propyl]-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one, 7-chloro-2-[3-(4-methylpiperazin-1-yl)propyl]-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one, RefChem:240894
| Molecular Formula | C17H22ClN5OS |
|---|---|
| Molecular Weight | 379.12 g/mol |
| LogP | 1.9306 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.12335 |
| Heavy Atoms | 25 |
| Complexity | 824.9311 |
Chemical Identifiers
| CAS Number | 110216-32-5 |
|---|---|
| SMILES | CN1CCN(CC1)CCCN2C(=O)N3C(=N2)CSC4=C3C=CC(=C4)Cl |
Product Overview
1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- (CAS 110216-32-5), with molecular formula C17H22ClN5OS and molecular weight 379.12 g/mol. IUPAC: 7-chloro-2-[3-(4-methylpiperazin-1-yl)propyl]-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one.
Chemical Property Profile of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-
Property Insights of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-
The XLogP value of 1.9306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-. With a topological polar surface area (TPSA) of 46.3 Ų, 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- has 0 hydrogen bond donor(s) and 5 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-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-?
The CAS number of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- is 110216-32-5.
What is the molecular formula of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-?
The molecular formula of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- is C17H22ClN5OS.
What is the molecular weight of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-?
The molecular weight of 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- is 379.12 g/mol.
Where can I buy 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-?
You can request a quote for 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-s-Triazolo(3,4-c)(1,4)benzothiazin-1-one, 2,4-dihydro-7-chloro-2-(3-(4-methyl-1-piperazinyl)propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.