KST-1A2078
TL;DR: KST-1A2078 (CAS 17683-84-0) is a chemical compound with molecular formula C25H25Cl2N3O4 and molecular weight 501.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]-3-methylanilino]ethyl N-(3-chlorophenyl)carbamate
Also Known As: KST-1A2078, [(3-methylphenyl)imino]diethane-2,1-diyl bis[(3-chlorophenyl)carbamate], 2-[N-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]-3-methylanilino]ethyl N-(3-chlorophenyl)carbamate, (benzylimino)diethane-2,1-diyl bis[(4-methoxyphenyl)carbamate], 2-[N-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]-3-methylanilino
| Molecular Formula | C25H25Cl2N3O4 |
|---|---|
| Molecular Weight | 501.12 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 501.12222 |
| Heavy Atoms | 34 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 17683-84-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N(CCOC(=O)NC2=CC(=CC=C2)Cl)CCOC(=O)NC3=CC(=CC=C3)Cl |
| InChIKey | LSYAMTGMWYMQEI-UHFFFAOYSA-N |
Product Overview
KST-1A2078 (CAS 17683-84-0), with molecular formula C25H25Cl2N3O4 and molecular weight 501.12 g/mol. IUPAC: 2-[N-[2-[(3-chlorophenyl)carbamoyloxy]ethyl]-3-methylanilino]ethyl N-(3-chlorophenyl)carbamate.
Chemical Property Profile of KST-1A2078
Property Insights of KST-1A2078
The XLogP value of 6.2 indicates that KST-1A2078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A2078. Following Lipinski's Rule of Five, KST-1A2078 has 2 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 KST-1A2078?
The CAS number of KST-1A2078 is 17683-84-0.
What is the molecular formula of KST-1A2078?
The molecular formula of KST-1A2078 is C25H25Cl2N3O4.
What is the molecular weight of KST-1A2078?
The molecular weight of KST-1A2078 is 501.12 g/mol.
Where can I buy KST-1A2078?
You can request a quote for KST-1A2078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2078?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.