Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-
TL;DR: Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- (CAS 40728-69-6) is a chemical compound with molecular formula C14H13BrN4O3S and molecular weight 395.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-bromophenyl)sulfonylphenyl]-3-(diaminomethylidene)urea
Also Known As: ((p-Bromophenyl)sulfonyl)phenylcarbamoylguanidine, 4-Bromophenyl 4'-(guanidinoformamido)phenyl sulfone, Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-, Sulfone, 4-bromophenyl 4'-(guanidinoformamido)phenyl, Urea, 1-amidino-3-(p-((p-bromophenyl)sulfonyl)phenyl)-
| Molecular Formula | C14H13BrN4O3S |
|---|---|
| Molecular Weight | 395.99 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.98917 |
| Heavy Atoms | 23 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 40728-69-6 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)N=C(N)N)S(=O)(=O)C2=CC=C(C=C2)Br |
| InChIKey | PTLQKHQTJCTUCI-UHFFFAOYSA-N |
Product Overview
Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- (CAS 40728-69-6), with molecular formula C14H13BrN4O3S and molecular weight 395.99 g/mol. IUPAC: 1-[4-(4-bromophenyl)sulfonylphenyl]-3-(diaminomethylidene)urea.
Chemical Property Profile of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-
Property Insights of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-. Following Lipinski's Rule of Five, Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- 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 Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-?
The CAS number of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- is 40728-69-6.
What is the molecular formula of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-?
The molecular formula of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- is C14H13BrN4O3S.
What is the molecular weight of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-?
The molecular weight of Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- is 395.99 g/mol.
Where can I buy Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-?
You can request a quote for Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, ((p-bromophenyl)sulfonyl)phenylcarbamoyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.