benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate
TL;DR: benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate (CAS 7505-30-8) is a chemical compound with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate
Also Known As: benzene-1,3,5-triol,ethyl N'-phenylcarbamimidothioate, benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate, benzene-1,3,5-triol; ethyl N'-phenylcarbamimidothioate, Ethyl N'-phenylcarbamimidothioate--benzene-1,3,5-triol (1/1)
| Molecular Formula | C15H18N2O3S |
|---|---|
| Molecular Weight | 306.10 g/mol |
| LogP | 3.1893 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.10382 |
| Heavy Atoms | 21 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 7505-30-8 |
|---|---|
| SMILES | CCSC(=NC1=CC=CC=C1)N.C1=C(C=C(C=C1O)O)O |
| InChIKey | IKYLRZFLCKBFHA-UHFFFAOYSA-N |
Product Overview
benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate (CAS 7505-30-8), with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol. IUPAC: benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate.
Chemical Property Profile of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate
Property Insights of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate
The XLogP value of 3.1893 indicates that benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate. Following Lipinski's Rule of Five, benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate has 4 hydrogen bond donor(s) and 5 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 benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate?
The CAS number of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate is 7505-30-8.
What is the molecular formula of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate?
The molecular formula of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate is C15H18N2O3S.
What is the molecular weight of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate?
The molecular weight of benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate is 306.10 g/mol.
Where can I buy benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate?
You can request a quote for benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for benzene-1,3,5-triol;ethyl N'-phenylcarbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.