![N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea structure](/static/products/1337/13372-58-2.webp)
N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea
TL;DR: N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea (CAS 13372-58-2) is a chemical compound with molecular formula C13H20N2O2S and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-[methyl-(4-methylphenyl)-oxo-λ6-sulfanylidene]urea
Also Known As: 1-butyl-3-[methyl-(4-methylphenyl)-oxo-, N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea, SULFOXIMIN,N-(N'-BUTYL-CARBAMOYL),METHYL,(4-TOLYL), N-Butyl-N'-(methyl(4-methylphenyl)oxido-lambda4-sulfanylidene)urea, N-Butyl-N'-[methyl(4-methylphenyl)oxo-lambda~6~-sulfanylidene]urea
| Molecular Formula | C13H20N2O2S |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.12454 |
| Heavy Atoms | 18 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 13372-58-2 |
|---|---|
| SMILES | CCCCNC(=O)N=S(=O)(C)C1=CC=C(C=C1)C |
| InChIKey | OYUXJCVOVNGVPN-UHFFFAOYSA-N |
Product Overview
N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea (CAS 13372-58-2), with molecular formula C13H20N2O2S and molecular weight 268.12 g/mol. IUPAC: 1-butyl-3-[methyl-(4-methylphenyl)-oxo-λ6-sulfanylidene]urea.
Chemical Property Profile of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea
Property Insights of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea
The XLogP value of 3.2 indicates that N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea. Following Lipinski's Rule of Five, N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea has 1 hydrogen bond donor(s) and 2 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-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea?
The CAS number of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea is 13372-58-2.
What is the molecular formula of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea?
The molecular formula of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea is C13H20N2O2S.
What is the molecular weight of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea?
The molecular weight of N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea is 268.12 g/mol.
Where can I buy N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea?
You can request a quote for N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea?
Yes, KEHONG BIO provides custom synthesis services for N-Butyl-N'-[methyl(4-methylphenyl)oxido-lambda4-sulfanylidene]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.