1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea
TL;DR: 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea (CAS 29456-83-5) is a chemical compound with molecular formula C14H22N2S and molecular weight 250.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-prop-2-enylthiourea
Also Known As: 1-Adamantan-1-yl-3-allyl-thiourea, 1-(1-adamantyl)-3-prop-2-enylthiourea, BAS 00063444, BIM-0004912.P001, 1-(ADAMANTAN-1-YL)-3-(PROP-2-EN-1-YL)THIOUREA
| Molecular Formula | C14H22N2S |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 2.6053 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.15038 |
| Heavy Atoms | 17 |
| Complexity | 301.8297 |
Chemical Identifiers
| CAS Number | 29456-83-5 |
|---|---|
| SMILES | C=CCNC(=S)NC12CC3CC(C1)CC(C3)C2 |
Product Overview
1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea (CAS 29456-83-5), with molecular formula C14H22N2S and molecular weight 250.15 g/mol. IUPAC: 1-(1-adamantyl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea
Property Insights of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea
The XLogP value of 2.6053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea has 2 hydrogen bond donor(s) and 1 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-(prop-2-EN-1-YL)thiourea?
The CAS number of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea is 29456-83-5.
What is the molecular formula of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea?
The molecular formula of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea is C14H22N2S.
What is the molecular weight of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea?
The molecular weight of 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea is 250.15 g/mol.
Where can I buy 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea?
You can request a quote for 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)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-(prop-2-EN-1-YL)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Adamantan-1-YL)-3-(prop-2-EN-1-YL)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.