N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea
TL;DR: N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea (CAS 134555-22-9) is a chemical compound with molecular formula C9H9N3NaO4S and molecular weight 278.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: Cnph-sme-urea, N-(4-cyanophenyl)-N/'-((sodiosulfo)methyl)urea, N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea, sodium;[(4-cyanophenyl)carbamoylamino]methanesulfonate, [(4-cyanophenyl)carbamoylamino]methanesulfonic acid; sodium
| Molecular Formula | C9H9N3NaO4S |
|---|---|
| Molecular Weight | 278.02 g/mol |
| LogP | 0.14428 |
| Topological Polar Surface Area | 119.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.02115 |
| Heavy Atoms | 18 |
| Complexity | 550.17065 |
Chemical Identifiers
| CAS Number | 134555-22-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NC(=O)NCS(=O)(=O)O.[Na] |
Product Overview
N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea (CAS 134555-22-9), with molecular formula C9H9N3NaO4S and molecular weight 278.02 g/mol.
Chemical Property Profile of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea
Property Insights of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea
The XLogP value of 0.14428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea. The TPSA of 119.29 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea. Following Lipinski's Rule of Five, N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea has 3 hydrogen bond donor(s) and 4 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-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea?
The CAS number of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea is 134555-22-9.
What is the molecular formula of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea?
The molecular formula of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea is C9H9N3NaO4S.
What is the molecular weight of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea?
The molecular weight of N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea is 278.02 g/mol.
Where can I buy N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea?
You can request a quote for N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Cyanophenyl)-N'-((sodiosulfo)methyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.