![s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate structure](/static/products/6289/62897-89-6.webp)
s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate
TL;DR: s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate (CAS 62897-89-6) is a chemical compound with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-(naphthalen-1-ylamino)-2-oxoethyl] carbamothioate
Also Known As: s-[2-(naphthalen-1-ylamino)-2-oxoethyl] carbamothioate, S-{2-[(Naphthalen-1-yl)amino]-2-oxoethyl} carbamothioate
| Molecular Formula | C13H12N2O2S |
|---|---|
| Molecular Weight | 260.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 97.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.06195 |
| Heavy Atoms | 18 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 62897-89-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)CSC(=O)N |
| InChIKey | WIEHBFPIPIMVEK-UHFFFAOYSA-N |
Product Overview
s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate (CAS 62897-89-6), with molecular formula C13H12N2O2S and molecular weight 260.06 g/mol. IUPAC: S-[2-(naphthalen-1-ylamino)-2-oxoethyl] carbamothioate.
Chemical Property Profile of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate
Property Insights of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate. Following Lipinski's Rule of Five, s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate has 2 hydrogen bond donor(s) and 3 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 s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate?
The CAS number of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate is 62897-89-6.
What is the molecular formula of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate?
The molecular formula of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate is C13H12N2O2S.
What is the molecular weight of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate?
The molecular weight of s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate is 260.06 g/mol.
Where can I buy s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate?
You can request a quote for s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for s-[2-(Naphthalen-1-ylamino)-2-oxoethyl] carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.