FR-227369 free base
TL;DR: FR-227369 free base (CAS 248958-46-5) is a chemical compound with molecular formula C13H15N3O4S and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(diaminomethylidene)-9-methylsulfonyl-2,3-dihydro-1-benzoxepine-4-carboxamide
Also Known As: FR-227369 free base, 1-Benzoxepin-4-carboxamide, N-(aminoiminomethyl)-2,3-dihydro-9-(methylsulfonyl)-
| Molecular Formula | C13H15N3O4S |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | 0.056 |
| Topological Polar Surface Area | 124.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.07834 |
| Heavy Atoms | 21 |
| Complexity | 746.67993 |
Chemical Identifiers
| CAS Number | 248958-46-5 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=CC2=C1OCCC(=C2)C(=O)N=C(N)N |
Product Overview
FR-227369 free base (CAS 248958-46-5), with molecular formula C13H15N3O4S and molecular weight 309.08 g/mol. IUPAC: N-(diaminomethylidene)-9-methylsulfonyl-2,3-dihydro-1-benzoxepine-4-carboxamide.
Chemical Property Profile of FR-227369 free base
Property Insights of FR-227369 free base
The XLogP value of 0.056 suggests moderate lipophilicity, balancing water solubility and membrane permeability for FR-227369 free base. The TPSA of 124.84 Ų falls within the moderate polarity range, balancing permeability and solubility for FR-227369 free base. Following Lipinski's Rule of Five, FR-227369 free base has 2 hydrogen bond donor(s) and 4 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 FR-227369 free base?
The CAS number of FR-227369 free base is 248958-46-5.
What is the molecular formula of FR-227369 free base?
The molecular formula of FR-227369 free base is C13H15N3O4S.
What is the molecular weight of FR-227369 free base?
The molecular weight of FR-227369 free base is 309.08 g/mol.
Where can I buy FR-227369 free base?
You can request a quote for FR-227369 free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for FR-227369 free base?
Yes, KEHONG BIO provides custom synthesis services for FR-227369 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.