Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-
TL;DR: Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- (CAS 56947-92-3) is a chemical compound with molecular formula C9H11ClN4O3S and molecular weight 290.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(chloromethylsulfonyl)phenyl]-3-(diaminomethylidene)urea
Also Known As: Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-, N-(Aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)urea, 1-[4-(chloromethylsulfonyl)phenyl]-3-(diaminomethylidene)urea, N-[4-(Chloromethanesulfonyl)phenyl]-N'-(diaminomethylidene)urea, BRN 3065913
| Molecular Formula | C9H11ClN4O3S |
|---|---|
| Molecular Weight | 290.02 g/mol |
| LogP | 0.4619 |
| Topological Polar Surface Area | 127.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.02405 |
| Heavy Atoms | 18 |
| Complexity | 563.98047 |
Chemical Identifiers
| CAS Number | 56947-92-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)N=C(N)N)S(=O)(=O)CCl |
Product Overview
Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- (CAS 56947-92-3), with molecular formula C9H11ClN4O3S and molecular weight 290.02 g/mol. IUPAC: 1-[4-(chloromethylsulfonyl)phenyl]-3-(diaminomethylidene)urea.
Chemical Property Profile of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-
Property Insights of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-
The XLogP value of 0.4619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-. The TPSA of 127.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-. Following Lipinski's Rule of Five, Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- has 3 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 Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-?
The CAS number of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- is 56947-92-3.
What is the molecular formula of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-?
The molecular formula of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- is C9H11ClN4O3S.
What is the molecular weight of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-?
The molecular weight of Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- is 290.02 g/mol.
Where can I buy Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-?
You can request a quote for Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(aminoiminomethyl)-N'-(4-((chloromethyl)sulfonyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.