Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-
TL;DR: Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- (CAS 23530-47-4) is a chemical compound with molecular formula C14H13N5O5S and molecular weight 363.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diaminomethylidene)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea
Also Known As: Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-, 1-amidino-3-[4-[sulfonyl]phenyl]urea, 1-Amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)urea, 1-Amidino-3-[4-[ sulfonyl]phenyl]urea, 1-(diaminomethylidene)-3-{4-[(4-nitrophenyl)sulfonyl]phenyl}urea
| Molecular Formula | C14H13N5O5S |
|---|---|
| Molecular Weight | 363.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.06375 |
| Heavy Atoms | 25 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 23530-47-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)N=C(N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | MTJALPBZRQUOPP-UHFFFAOYSA-N |
Product Overview
Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- (CAS 23530-47-4), with molecular formula C14H13N5O5S and molecular weight 363.06 g/mol. IUPAC: 1-(diaminomethylidene)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea.
Chemical Property Profile of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-
Property Insights of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-. The TPSA of 182.0 Ų indicates high polarity, suggesting Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- has 3 hydrogen bond donor(s) and 5 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, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-?
The CAS number of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- is 23530-47-4.
What is the molecular formula of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-?
The molecular formula of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- is C14H13N5O5S.
What is the molecular weight of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-?
The molecular weight of Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- is 363.06 g/mol.
Where can I buy Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-?
You can request a quote for Urea, 1-amidino-3-(p-((p-nitrophenyl)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, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-amidino-3-(p-((p-nitrophenyl)sulfonyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.