1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea
TL;DR: 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea (CAS 327086-45-3) is a chemical compound with molecular formula C19H27N3S and molecular weight 329.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[4-(dimethylamino)phenyl]thiourea
Also Known As: 1-(1-adamantyl)-3-(4-dimethylaminophenyl)thiourea, 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea
| Molecular Formula | C19H27N3S |
|---|---|
| Molecular Weight | 329.19 g/mol |
| LogP | 4.0078 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.19257 |
| Heavy Atoms | 23 |
| Complexity | 557.853 |
Chemical Identifiers
| CAS Number | 327086-45-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC(=S)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea (CAS 327086-45-3), with molecular formula C19H27N3S and molecular weight 329.19 g/mol. IUPAC: 1-(1-adamantyl)-3-[4-(dimethylamino)phenyl]thiourea.
Chemical Property Profile of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea
Property Insights of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea
The XLogP value of 4.0078 indicates that 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea has 2 hydrogen bond donor(s) and 2 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-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea?
The CAS number of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea is 327086-45-3.
What is the molecular formula of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea?
The molecular formula of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea is C19H27N3S.
What is the molecular weight of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea?
The molecular weight of 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea is 329.19 g/mol.
Where can I buy 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea?
You can request a quote for 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Adamantan-1-yl)-3-(4-(dimethylamino)phenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.