Pyrrolo[2,1-c][1,4]benzothiazin-4-one
TL;DR: Pyrrolo[2,1-c][1,4]benzothiazin-4-one (CAS 43153-79-3) is a chemical compound with molecular formula C11H7NOS and molecular weight 201.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolo[2,1-c][1,4]benzothiazin-4-one
Also Known As: 4H-pyrrolo[2,1-c][1,4]benzothiazin-4-one, pyrrolo[2,1-c][1,4]benzothiazin-4-one
| Molecular Formula | C11H7NOS |
|---|---|
| Molecular Weight | 201.02 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.02484 |
| Heavy Atoms | 14 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 43153-79-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C=CC=C3C(=O)S2 |
| InChIKey | IWMSMYYYDXIHMP-UHFFFAOYSA-N |
Product Overview
Pyrrolo[2,1-c][1,4]benzothiazin-4-one (CAS 43153-79-3), with molecular formula C11H7NOS and molecular weight 201.02 g/mol. IUPAC: pyrrolo[2,1-c][1,4]benzothiazin-4-one.
Chemical Property Profile of Pyrrolo[2,1-c][1,4]benzothiazin-4-one
Property Insights of Pyrrolo[2,1-c][1,4]benzothiazin-4-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo[2,1-c][1,4]benzothiazin-4-one. With a topological polar surface area (TPSA) of 47.3 Ų, Pyrrolo[2,1-c][1,4]benzothiazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo[2,1-c][1,4]benzothiazin-4-one has 0 hydrogen bond donor(s) and 2 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 Pyrrolo[2,1-c][1,4]benzothiazin-4-one?
The CAS number of Pyrrolo[2,1-c][1,4]benzothiazin-4-one is 43153-79-3.
What is the molecular formula of Pyrrolo[2,1-c][1,4]benzothiazin-4-one?
The molecular formula of Pyrrolo[2,1-c][1,4]benzothiazin-4-one is C11H7NOS.
What is the molecular weight of Pyrrolo[2,1-c][1,4]benzothiazin-4-one?
The molecular weight of Pyrrolo[2,1-c][1,4]benzothiazin-4-one is 201.02 g/mol.
Where can I buy Pyrrolo[2,1-c][1,4]benzothiazin-4-one?
You can request a quote for Pyrrolo[2,1-c][1,4]benzothiazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo[2,1-c][1,4]benzothiazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo[2,1-c][1,4]benzothiazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.