Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-
TL;DR: Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- (CAS 134616-49-2) is a chemical compound with molecular formula C17H14N2OS and molecular weight 294.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
Also Known As: 1-(4-Methylphenyl)-3,3a-dihydropyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-, 1-(4-methylphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one, 1-(4-Methylphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2(1H)-one, BRN 4816731
| Molecular Formula | C17H14N2OS |
|---|---|
| Molecular Weight | 294.08 g/mol |
| LogP | 3.93622 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.08267 |
| Heavy Atoms | 21 |
| Complexity | 751.6404 |
Chemical Identifiers
| CAS Number | 134616-49-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)CC3C2=NC4=CC=CC=C4S3 |
Product Overview
Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- (CAS 134616-49-2), with molecular formula C17H14N2OS and molecular weight 294.08 g/mol. IUPAC: 1-(4-methylphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one.
Chemical Property Profile of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-
Property Insights of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-
The XLogP value of 3.93622 indicates that Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- has 0 hydrogen bond donor(s) and 3 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(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-?
The CAS number of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- is 134616-49-2.
What is the molecular formula of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-?
The molecular formula of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- is C17H14N2OS.
What is the molecular weight of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-?
The molecular weight of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- is 294.08 g/mol.
Where can I buy Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-?
You can request a quote for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.