10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine
TL;DR: 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine (CAS 477864-54-3) is a chemical compound with molecular formula C18H13BrN2S and molecular weight 368.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[(4-bromophenyl)methyl]pyrido[3,2-b][1,4]benzothiazine
Also Known As: Bionet1_003245, 1G-424S, 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine, 10-[(4-bromophenyl)methyl]pyrido[3,2-b][1,4]benzothiazine, 2-[(4-bromophenyl)methyl]-9-thia-2,4-diazatricyclo[8.4.0.0^{3,8}]tetradeca-1(10),3,5,7,11,13-hexaene
| Molecular Formula | C18H13BrN2S |
|---|---|
| Molecular Weight | 368.00 g/mol |
| LogP | 5.647 |
| Topological Polar Surface Area | 16.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 367.9983 |
| Heavy Atoms | 22 |
| Complexity | 771.826 |
Chemical Identifiers
| CAS Number | 477864-54-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C3=C(S2)C=CC=N3)CC4=CC=C(C=C4)Br |
Product Overview
10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine (CAS 477864-54-3), with molecular formula C18H13BrN2S and molecular weight 368.00 g/mol. IUPAC: 10-[(4-bromophenyl)methyl]pyrido[3,2-b][1,4]benzothiazine.
Chemical Property Profile of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine
Property Insights of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine
The XLogP value of 5.647 indicates that 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.13 Ų, 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine?
The CAS number of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine is 477864-54-3.
What is the molecular formula of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine?
The molecular formula of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine is C18H13BrN2S.
What is the molecular weight of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine?
The molecular weight of 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine is 368.00 g/mol.
Where can I buy 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine?
You can request a quote for 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine?
Yes, KEHONG BIO provides custom synthesis services for 10-(4-bromobenzyl)-10H-pyrido[3,2-b][1,4]benzothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.