6P-534S
TL;DR: 6P-534S (CAS 478063-38-6) is a chemical compound with molecular formula C23H26Cl2N2OS2 and molecular weight 480.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]phenol
Also Known As: 6P-534S, 2,6-di(tert-butyl)-4-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzenol, 2,6-di-tert-butyl-4-(5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)phenol, 2,6-ditert-butyl-4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]phenol, 2,6-ditert-butyl-4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-3H-1,3,4-thiadiazol-2-ylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C23H26Cl2N2OS2 |
|---|---|
| Molecular Weight | 480.09 g/mol |
| LogP | 8.1048 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 480.08636 |
| Heavy Atoms | 30 |
| Complexity | 1030.7906 |
Chemical Identifiers
| CAS Number | 478063-38-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=NN=C(S2)SCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
6P-534S (CAS 478063-38-6), with molecular formula C23H26Cl2N2OS2 and molecular weight 480.09 g/mol. IUPAC: 2,6-ditert-butyl-4-[5-[(3,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]phenol.
Chemical Property Profile of 6P-534S
Property Insights of 6P-534S
The XLogP value of 8.1048 indicates that 6P-534S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.01 Ų, 6P-534S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6P-534S has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6P-534S?
The CAS number of 6P-534S is 478063-38-6.
What is the molecular formula of 6P-534S?
The molecular formula of 6P-534S is C23H26Cl2N2OS2.
What is the molecular weight of 6P-534S?
The molecular weight of 6P-534S is 480.09 g/mol.
Where can I buy 6P-534S?
You can request a quote for 6P-534S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6P-534S?
Yes, KEHONG BIO provides custom synthesis services for 6P-534S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.