4H-Pyrrolo(2,1-c)(1,4)benzothiazine
TL;DR: 4H-Pyrrolo(2,1-c)(1,4)benzothiazine (CAS 43153-80-6) is a chemical compound with molecular formula C11H9NS and molecular weight 187.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4H-pyrrolo[2,1-c][1,4]benzothiazine
Also Known As: 4H-Pyrrolo(2,1-c)(1,4)benzothiazine, 4H-pyrrolo[2,1-c][1,4]benzothiazine, 8-thia-2-azatricyclo[7.4.0.02,6]trideca-1(13),3,5,9,11-pentaene, RefChem:100706
| Molecular Formula | C11H9NS |
|---|---|
| Molecular Weight | 187.05 g/mol |
| LogP | 3.083 |
| Topological Polar Surface Area | 4.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.04558 |
| Heavy Atoms | 13 |
| Complexity | 444.85587 |
Chemical Identifiers
| CAS Number | 43153-80-6 |
|---|---|
| SMILES | C1C2=CC=CN2C3=CC=CC=C3S1 |
Product Overview
4H-Pyrrolo(2,1-c)(1,4)benzothiazine (CAS 43153-80-6), with molecular formula C11H9NS and molecular weight 187.05 g/mol. IUPAC: 4H-pyrrolo[2,1-c][1,4]benzothiazine.
Chemical Property Profile of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine
Property Insights of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine
The XLogP value of 3.083 indicates that 4H-Pyrrolo(2,1-c)(1,4)benzothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.93 Ų, 4H-Pyrrolo(2,1-c)(1,4)benzothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Pyrrolo(2,1-c)(1,4)benzothiazine has 0 hydrogen bond donor(s) and 1 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 4H-Pyrrolo(2,1-c)(1,4)benzothiazine?
The CAS number of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine is 43153-80-6.
What is the molecular formula of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine?
The molecular formula of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine is C11H9NS.
What is the molecular weight of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine?
The molecular weight of 4H-Pyrrolo(2,1-c)(1,4)benzothiazine is 187.05 g/mol.
Where can I buy 4H-Pyrrolo(2,1-c)(1,4)benzothiazine?
You can request a quote for 4H-Pyrrolo(2,1-c)(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 4H-Pyrrolo(2,1-c)(1,4)benzothiazine?
Yes, KEHONG BIO provides custom synthesis services for 4H-Pyrrolo(2,1-c)(1,4)benzothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.