1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate
TL;DR: 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate (CAS 764655-61-0) is a chemical compound with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]naphthalen-2-yl] 2-chlorobenzoate
Also Known As: 1-(2-((ETHYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2-CHLOROBENZOATE, [1-[(ethylthiocarbamoylhydrazinylidene)methyl]naphthalen-2-yl] 2-chlorobenzoate, 643-130-9, RefChem:420872
| Molecular Formula | C21H18ClN3O2S |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 4.5303 |
| Topological Polar Surface Area | 62.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.0808 |
| Heavy Atoms | 28 |
| Complexity | 1052.7551 |
Chemical Identifiers
| CAS Number | 764655-61-0 |
|---|---|
| SMILES | CCNC(=S)N/N=C/C1=C(C=CC2=CC=CC=C21)OC(=O)C3=CC=CC=C3Cl |
Product Overview
1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate (CAS 764655-61-0), with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol. IUPAC: [1-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]naphthalen-2-yl] 2-chlorobenzoate.
Chemical Property Profile of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate
Property Insights of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate
The XLogP value of 4.5303 indicates that 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate. Following Lipinski's Rule of Five, 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate has 2 hydrogen bond donor(s) and 4 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 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate?
The CAS number of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate is 764655-61-0.
What is the molecular formula of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate?
The molecular formula of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate is C21H18ClN3O2S.
What is the molecular weight of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate?
The molecular weight of 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate is 411.08 g/mol.
Where can I buy 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate?
You can request a quote for 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-((Ethylamino)carbothioyl)carbohydrazonoyl)-2-naphthyl 2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.