Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-
TL;DR: Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- (CAS 134616-50-5) is a chemical compound with molecular formula C16H11ClN2OS and molecular weight 314.02808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chlorophenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
Also Known As: 1-(3-Chlorophenyl)-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-(3-chlorophenyl)-, 1-(3-chlorophenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one, 1-(3-Chlorophenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2(1H)-one, BRN 4818239
Technical Specifications
| Molecular Formula | C16H11ClN2OS |
| Molecular Weight | 314.02808 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.02808 Da |
| Heavy Atoms | 21 |
| Complexity | 469.0 |
| SMILES | C1C2C(=NC3=CC=CC=C3S2)N(C1=O)C4=CC(=CC=C4)Cl |
| InChIKey | ZVTLJXYZEPECAC-UHFFFAOYSA-N |
Chemical Property Profile of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-
Property Insights of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-
The XLogP value of 3.4 indicates that Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.0 Ų, Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- 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-(3-chlorophenyl)- 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
What is the CAS number of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-?
The CAS number of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- is 134616-50-5.
What is the molecular formula of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-?
The molecular formula of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- is C16H11ClN2OS.
What is the molecular weight of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-?
The molecular weight of Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- is 314.02808 g/mol.
Where can I buy Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-?
You can request a quote for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)-?
Yes, CoreyChem provides custom synthesis services for Pyrrolo(3,2-b)(1,4)benzothiazin-2(1H)-one, 3,3a-dihydro-1-(3-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.