3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione
TL;DR: 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione (CAS 338415-41-1) is a chemical compound with molecular formula C15H10FNO2S and molecular weight 287.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-fluorophenyl)methyl]-1,3-benzothiazine-2,4-dione
Also Known As: 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione, 3-[(2-fluorophenyl)methyl]-1,3-benzothiazine-2,4-dione, 3-[(2-fluorophenyl)methyl]-3,4-dihydro-2H-1,3-benzothiazine-2,4-dione, 3-[(2-Fluorophenyl)methyl]-2H-1,3-benzothiazine-2,4(3H)-dione, 9-[(2-fluorophenyl)methyl]-7-thia-9-azabicyclo[4.4.0]deca-1,3,5-triene-8,10-dione
| Molecular Formula | C15H10FNO2S |
|---|---|
| Molecular Weight | 287.04 g/mol |
| LogP | 2.6106 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.04163 |
| Heavy Atoms | 20 |
| Complexity | 898.0044 |
Chemical Identifiers
| CAS Number | 338415-41-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3SC2=O)F |
Product Overview
3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione (CAS 338415-41-1), with molecular formula C15H10FNO2S and molecular weight 287.04 g/mol. IUPAC: 3-[(2-fluorophenyl)methyl]-1,3-benzothiazine-2,4-dione.
Chemical Property Profile of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione
Property Insights of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione
The XLogP value of 2.6106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione. With a topological polar surface area (TPSA) of 39.07 Ų, 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione 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 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione?
The CAS number of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione is 338415-41-1.
What is the molecular formula of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione?
The molecular formula of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione is C15H10FNO2S.
What is the molecular weight of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione?
The molecular weight of 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione is 287.04 g/mol.
Where can I buy 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione?
You can request a quote for 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-fluorobenzyl)-2H-1,3-benzothiazine-2,4(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.