ChemDiv1_015827
TL;DR: ChemDiv1_015827 (CAS 451509-57-2) is a chemical compound with molecular formula C26H25FN2O6S and molecular weight 512.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-N-(4-phenoxyphenyl)benzamide
Also Known As: ChemDiv1_015827, 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-N-(4-phenoxyphenyl)benzamide, F0917-1322, 3-{1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl}-4-fluoro-N-(4-phenoxyphenyl)benzamide
| Molecular Formula | C26H25FN2O6S |
|---|---|
| Molecular Weight | 512.14 g/mol |
| LogP | 4.3979 |
| Topological Polar Surface Area | 94.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 512.1417 |
| Heavy Atoms | 36 |
| Complexity | 1332.6072 |
Chemical Identifiers
| CAS Number | 451509-57-2 |
|---|---|
| SMILES | C1CN(CCC12OCCO2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)F |
Product Overview
ChemDiv1_015827 (CAS 451509-57-2), with molecular formula C26H25FN2O6S and molecular weight 512.14 g/mol. IUPAC: 3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylsulfonyl)-4-fluoro-N-(4-phenoxyphenyl)benzamide.
Chemical Property Profile of ChemDiv1_015827
Property Insights of ChemDiv1_015827
The XLogP value of 4.3979 indicates that ChemDiv1_015827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.17 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_015827. Following Lipinski's Rule of Five, ChemDiv1_015827 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_015827?
The CAS number of ChemDiv1_015827 is 451509-57-2.
What is the molecular formula of ChemDiv1_015827?
The molecular formula of ChemDiv1_015827 is C26H25FN2O6S.
What is the molecular weight of ChemDiv1_015827?
The molecular weight of ChemDiv1_015827 is 512.14 g/mol.
Where can I buy ChemDiv1_015827?
You can request a quote for ChemDiv1_015827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_015827?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_015827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.