![N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea structure](/static/products/6220/62209-44-3.webp)
N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea
TL;DR: N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea (CAS 62209-44-3) is a chemical compound with molecular formula C17H23N3O4S2 and molecular weight 397.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-sulfosulfanylethylamino)butylcarbamoylamino]naphthalene
Also Known As: N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea, 1-[4-(2-sulfosulfanylethylamino)butylcarbamoylamino]naphthalene, S-(2-[(4-([(1-Naphthylamino)carbonyl]amino)butyl)amino]ethyl) hydrogen thiosulfate #
| Molecular Formula | C17H23N3O4S2 |
|---|---|
| Molecular Weight | 397.11 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 397.113 |
| Heavy Atoms | 26 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 62209-44-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC(=O)NCCCCNCCSS(=O)(=O)O |
| InChIKey | IAGSCTNIJUHVRO-UHFFFAOYSA-N |
Product Overview
N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea (CAS 62209-44-3), with molecular formula C17H23N3O4S2 and molecular weight 397.11 g/mol. IUPAC: 1-[4-(2-sulfosulfanylethylamino)butylcarbamoylamino]naphthalene.
Chemical Property Profile of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea
Property Insights of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea
The XLogP value of -0.5 indicates that N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea has 4 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 N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea?
The CAS number of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea is 62209-44-3.
What is the molecular formula of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea?
The molecular formula of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea is C17H23N3O4S2.
What is the molecular weight of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea?
The molecular weight of N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea is 397.11 g/mol.
Where can I buy N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea?
You can request a quote for N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea?
Yes, KEHONG BIO provides custom synthesis services for N-1-Naphthyl-N'-4-[2-sulfothioethyl]aminobutylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.