1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate
TL;DR: 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate (CAS 767320-58-1) is a chemical compound with molecular formula C21H19N3O4S and molecular weight 409.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(E)-(carbamothioylhydrazinylidene)methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate
Also Known As: 1-(2-(AMINOCARBOTHIOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE, [1-[(carbamothioylhydrazinylidene)methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate, 643-473-4, RefChem:421158
| Molecular Formula | C21H19N3O4S |
|---|---|
| Molecular Weight | 409.11 g/mol |
| LogP | 3.2433 |
| Topological Polar Surface Area | 95.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.10962 |
| Heavy Atoms | 29 |
| Complexity | 1098.4764 |
Chemical Identifiers
| CAS Number | 767320-58-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC2=C(C3=CC=CC=C3C=C2)/C=N/NC(=S)N)OC |
Product Overview
1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate (CAS 767320-58-1), with molecular formula C21H19N3O4S and molecular weight 409.11 g/mol. IUPAC: [1-[(E)-(carbamothioylhydrazinylidene)methyl]naphthalen-2-yl] 3,4-dimethoxybenzoate.
Chemical Property Profile of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate
Property Insights of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate
The XLogP value of 3.2433 indicates that 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate. Following Lipinski's Rule of Five, 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate has 2 hydrogen bond donor(s) and 6 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-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate?
The CAS number of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate is 767320-58-1.
What is the molecular formula of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate?
The molecular formula of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate is C21H19N3O4S.
What is the molecular weight of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate?
The molecular weight of 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate is 409.11 g/mol.
Where can I buy 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate?
You can request a quote for 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(Aminocarbothioyl)carbohydrazonoyl)-2-naphthyl 3,4-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.