ChemDiv1_026503
TL;DR: ChemDiv1_026503 (CAS 1093406-43-9) is a chemical compound with molecular formula C18H21ClFNO6 and molecular weight 401.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: ChemDiv1_026503, DivK1c_004247, CDS1_003207, BAS 03281328, F1507-0135
| Molecular Formula | C18H21ClFNO6 |
|---|---|
| Molecular Weight | 401.10 g/mol |
| LogP | 2.8141 |
| Topological Polar Surface Area | 75.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 401.10416 |
| Heavy Atoms | 27 |
| Complexity | 772.2188 |
Chemical Identifiers
| CAS Number | 1093406-43-9 |
|---|---|
| SMILES | CC1(OC2C(O1)C(OC3C2OC(O3)(C)C)C(=O)NC4=CC(=C(C=C4)F)Cl)C |
Product Overview
ChemDiv1_026503 (CAS 1093406-43-9), with molecular formula C18H21ClFNO6 and molecular weight 401.10 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide.
Chemical Property Profile of ChemDiv1_026503
Property Insights of ChemDiv1_026503
The XLogP value of 2.8141 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_026503. The TPSA of 75.25 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_026503. Following Lipinski's Rule of Five, ChemDiv1_026503 has 1 hydrogen bond donor(s) and 6 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 ChemDiv1_026503?
The CAS number of ChemDiv1_026503 is 1093406-43-9.
What is the molecular formula of ChemDiv1_026503?
The molecular formula of ChemDiv1_026503 is C18H21ClFNO6.
What is the molecular weight of ChemDiv1_026503?
The molecular weight of ChemDiv1_026503 is 401.10 g/mol.
Where can I buy ChemDiv1_026503?
You can request a quote for ChemDiv1_026503 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_026503?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_026503 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.