KS 504d
TL;DR: KS 504d (CAS 122005-23-6) is a chemical compound with molecular formula C7H4Cl8O2 and molecular weight 399.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4,4-tetrachloro-1-(dichloromethyl)-5-(dichloromethylidene)cyclopentane-1,3-diol
Also Known As: KS 504d, 2,2,4,4-tetrachloro-1-(dichloromethyl)-5-(dichloromethylidene)cyclopentane-1,3-diol, (+)-1-(Dichloromethyl)-5-(dichloromethylene)-2,2,4,4-tetrachloro-1,3-cyclopentanediol, 1,3-Cyclopentanediol, 1-(dichloromethyl)-5-(dichloromethylene)-2,2,4,4-tetrachloro-, (+)-, 1,3-Cyclopentanediol, 2,2,4,4-tetrachloro-1-(dichloromethyl)-5-(dichloromethylene)-, (+)-
| Molecular Formula | C7H4Cl8O2 |
|---|---|
| Molecular Weight | 399.77 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 399.77194 |
| Heavy Atoms | 17 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 122005-23-6 |
|---|---|
| SMILES | C1(C(C(=C(Cl)Cl)C(C1(Cl)Cl)(C(Cl)Cl)O)(Cl)Cl)O |
| InChIKey | NRIHIELKVOSNAZ-UHFFFAOYSA-N |
Product Overview
KS 504d (CAS 122005-23-6), with molecular formula C7H4Cl8O2 and molecular weight 399.77 g/mol. IUPAC: 2,2,4,4-tetrachloro-1-(dichloromethyl)-5-(dichloromethylidene)cyclopentane-1,3-diol.
Chemical Property Profile of KS 504d
Property Insights of KS 504d
The XLogP value of 3.4 indicates that KS 504d is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, KS 504d exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KS 504d has 2 hydrogen bond donor(s) and 2 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 KS 504d?
The CAS number of KS 504d is 122005-23-6.
What is the molecular formula of KS 504d?
The molecular formula of KS 504d is C7H4Cl8O2.
What is the molecular weight of KS 504d?
The molecular weight of KS 504d is 399.77 g/mol.
Where can I buy KS 504d?
You can request a quote for KS 504d directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KS 504d?
Yes, KEHONG BIO provides custom synthesis services for KS 504d and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.