ZD 6021
TL;DR: ZD 6021 (CAS 255049-08-2) is a chemical compound with molecular formula C35H35Cl2N3O2S and molecular weight 631.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyano-N-[(2S)-2-(3,4-dichlorophenyl)-4-[4-[2-[(S)-methylsulfinyl]phenyl]piperidin-1-yl]butyl]-N-methylnaphthalene-1-carboxamide
Also Known As: ZD 6021, 3-cyano-N-[(2S)-2-(3,4-dichlorophenyl)-4-[4-[2-[(S)-methylsulfinyl]phenyl]piperidin-1-yl]butyl]-N-methylnaphthalene-1-carboxamide, (3-cyano-N-(2-(3,4-dichlorophenyl)-4-(4-(2-(methylsulfinyl)phenyl)piperidino)butyl)-N-methyl)naphthamide, (S)-3-Cyano-naphthalene-1-carboxylic acid {2-(3,4-dichloro-phenyl)-4-[4-(2-methanesulfinyl-phenyl)-piperidin-1-yl]-butyl}-methyl-amide, 3-cyano-N-((2S)-2-(3,4-dichlorophenyl)-4-(4-(2-((S)-methylsulfinyl)phenyl)piperidin-1-yl)butyl)-N-methylnaphthalene-1-carboxamide
| Molecular Formula | C35H35Cl2N3O2S |
|---|---|
| Molecular Weight | 631.18 g/mol |
| LogP | 7.88118 |
| Topological Polar Surface Area | 64.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 631.1827 |
| Heavy Atoms | 43 |
| Complexity | 1694.5681 |
Chemical Identifiers
| CAS Number | 255049-08-2 |
|---|---|
| SMILES | CN(C[C@@H](CCN1CCC(CC1)C2=CC=CC=C2[S@@](=O)C)C3=CC(=C(C=C3)Cl)Cl)C(=O)C4=CC(=CC5=CC=CC=C54)C#N |
Product Overview
ZD 6021 (CAS 255049-08-2), with molecular formula C35H35Cl2N3O2S and molecular weight 631.18 g/mol. IUPAC: 3-cyano-N-[(2S)-2-(3,4-dichlorophenyl)-4-[4-[2-[(S)-methylsulfinyl]phenyl]piperidin-1-yl]butyl]-N-methylnaphthalene-1-carboxamide.
Chemical Property Profile of ZD 6021
Property Insights of ZD 6021
The XLogP value of 7.88118 indicates that ZD 6021 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.41 Ų falls within the moderate polarity range, balancing permeability and solubility for ZD 6021. Following Lipinski's Rule of Five, ZD 6021 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ZD 6021?
The CAS number of ZD 6021 is 255049-08-2.
What is the molecular formula of ZD 6021?
The molecular formula of ZD 6021 is C35H35Cl2N3O2S.
What is the molecular weight of ZD 6021?
The molecular weight of ZD 6021 is 631.18 g/mol.
Where can I buy ZD 6021?
You can request a quote for ZD 6021 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZD 6021?
Yes, KEHONG BIO provides custom synthesis services for ZD 6021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.