![[2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate structure](/static/products/489/489463-15-2.png)
[2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate
TL;DR: [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate (CAS 489463-15-2) is a chemical compound with molecular formula C31H30N4OS and molecular weight 506.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate
Also Known As: [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate|2-((3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)amino)-2-oxoethyl diphenylcarbamimidothioate|2-[(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)amino]-2-oxoethyl N,N-diphenylcarbamimidothioate
| Molecular Formula | C31H30N4OS |
|---|---|
| Molecular Weight | 506.21 g/mol |
| LogP | 7.05035 |
| Topological Polar Surface Area | 79.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 506.21402 |
| Heavy Atoms | 37 |
| Complexity | 1315.2152 |
Chemical Identifiers
| CAS Number | 489463-15-2 |
|---|---|
| SMILES | C1CCC2(CC1)CC3=CC=CC=C3C(=C2C#N)NC(=O)CSC(=N)N(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
[2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate (CAS 489463-15-2), with molecular formula C31H30N4OS and molecular weight 506.21 g/mol. IUPAC: [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate.
Chemical Property Profile of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate
Property Insights of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate
The XLogP value of 7.05035 indicates that [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.98 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate. Following Lipinski's Rule of Five, [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate has 2 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 [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate?
The CAS number of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate is 489463-15-2.
What is the molecular formula of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate?
The molecular formula of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate is C31H30N4OS.
What is the molecular weight of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate?
The molecular weight of [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate is 506.21 g/mol.
Where can I buy [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate?
You can request a quote for [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)amino]-2-oxoethyl] N,N-diphenylcarbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.