RefChem:318719
TL;DR: RefChem:318719 (CAS 66827-21-2) is a chemical compound with molecular formula C17H22BrN3S and molecular weight 379.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium bromide
Also Known As: (2-(10H-Pyrido(3,2-b)(1,4)benzothiazin-10-yl)propyl)trimethylammonium bromide, Ammonium, (2-(10H-pyrido(3,2-b)(1,4)benzothiazin-10-yl)propyl)trimethyl-, bromide, trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium bromide, (2-(10H-PYRIDO(3,2-B)[1,4]BENZOTHIAZIN-10-YL)PROPYL)TRIMETHYLAMMONIUM BROMIDE, 10H-Pyrido[3,2-b][1,4]benzothiazine-10-ethanaminium, N,N,N,.beta.-tetramethyl-, bromide
| Molecular Formula | C17H22BrN3S |
|---|---|
| Molecular Weight | 379.07 g/mol |
| LogP | 0.78 |
| Topological Polar Surface Area | 41.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.07178 |
| Heavy Atoms | 22 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 66827-21-2 |
|---|---|
| SMILES | CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3.[Br-] |
| InChIKey | DNRPCACHVPBEAZ-UHFFFAOYSA-M |
Product Overview
RefChem:318719 (CAS 66827-21-2), with molecular formula C17H22BrN3S and molecular weight 379.07 g/mol. IUPAC: trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium bromide.
Chemical Property Profile of RefChem:318719
Property Insights of RefChem:318719
The XLogP value of 0.78 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:318719. With a topological polar surface area (TPSA) of 41.4 Ų, RefChem:318719 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318719 has 0 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 RefChem:318719?
The CAS number of RefChem:318719 is 66827-21-2.
What is the molecular formula of RefChem:318719?
The molecular formula of RefChem:318719 is C17H22BrN3S.
What is the molecular weight of RefChem:318719?
The molecular weight of RefChem:318719 is 379.07 g/mol.
Where can I buy RefChem:318719?
You can request a quote for RefChem:318719 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318719?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318719 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.