1fls
TL;DR: 1fls (CAS 206551-25-9) is a chemical compound with molecular formula C21H21N3O5S and molecular weight 427.12018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
WAY
N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methylbenzamide
Also Known As: 1fls, WAY 151693, J1.346.962H, n-hydroxy-2-[(4-methoxy-benzenesulfonyl)-pyridin-3-ylmethyl-amino]-3-methyl-benzamide, N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methylbenzamide
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H21N3O5S |
| Molecular Weight | 427.12018 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.12018 Da |
| Heavy Atoms | 30 |
| Complexity | 660.0 |
| SMILES | CC1=C(C(=CC=C1)C(=O)NO)N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC |
| InChIKey | AINJYWXKBKRQSX-UHFFFAOYSA-N |
Chemical Property Profile of 1fls
Property Insights of 1fls
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1fls. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1fls. Following Lipinski's Rule of Five, 1fls has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1fls?
The CAS number of 1fls is 206551-25-9.
What is the molecular formula of 1fls?
The molecular formula of 1fls is C21H21N3O5S.
What is the molecular weight of 1fls?
The molecular weight of 1fls is 427.12018 g/mol.
Where can I buy 1fls?
You can request a quote for 1fls directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1fls?
Yes, CoreyChem provides custom synthesis services for 1fls and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.