1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea
TL;DR: 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea (CAS 380426-22-2) is a chemical compound with molecular formula C18H23N3O3S2 and molecular weight 393.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-sulfamoylphenyl)carbamothioyl]adamantane-1-carboxamide
Also Known As: 1-(ADAMANTANE-1-CARBONYL)-3-(3-SULFAMOYLPHENYL)THIOUREA, 1-(1-Adamantylcarbonyl)-3-(3-aminosulfonylphenyl)thiourea, N-[(3-sulfamoylphenyl)carbamothioyl]adamantane-1-carboxamide, N-[(3-sulfamoylphenyl)thiocarbamoyl]adamantane-1-carboxamide, 3-({[(1-adamantylcarbonyl)amino]carbothioyl}amino)benzenesulfonamide
| Molecular Formula | C18H23N3O3S2 |
|---|---|
| Molecular Weight | 393.12 g/mol |
| LogP | 2.3634 |
| Topological Polar Surface Area | 101.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.11807 |
| Heavy Atoms | 26 |
| Complexity | 830.903 |
Chemical Identifiers
| CAS Number | 380426-22-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC(=CC=C4)S(=O)(=O)N |
Product Overview
1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea (CAS 380426-22-2), with molecular formula C18H23N3O3S2 and molecular weight 393.12 g/mol. IUPAC: N-[(3-sulfamoylphenyl)carbamothioyl]adamantane-1-carboxamide.
Chemical Property Profile of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea
Property Insights of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea
The XLogP value of 2.3634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea. The TPSA of 101.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea. Following Lipinski's Rule of Five, 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea 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 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea?
The CAS number of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea is 380426-22-2.
What is the molecular formula of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea?
The molecular formula of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea is C18H23N3O3S2.
What is the molecular weight of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea?
The molecular weight of 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea is 393.12 g/mol.
Where can I buy 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea?
You can request a quote for 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Adamantane-1-carbonyl)-3-(3-sulfamoylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.