1,2-Dihydroacenaphthylen-5-ylthiourea
TL;DR: 1,2-Dihydroacenaphthylen-5-ylthiourea (CAS 100724-82-1) is a chemical compound with molecular formula C13H12N2S and molecular weight 228.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dihydroacenaphthylen-5-ylthiourea
Also Known As: 1,2-dihydroacenaphthylen-5-ylthiourea, N-(1,2-dihydro-5-acenaphthylenyl)thiourea, 1-(1,2-dihydroacenaphthylen-5-yl)thiourea, AQ-344/43100129
| Molecular Formula | C13H12N2S |
|---|---|
| Molecular Weight | 228.07 g/mol |
| LogP | 2.5939 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.07211 |
| Heavy Atoms | 16 |
| Complexity | 579.49744 |
Chemical Identifiers
| CAS Number | 100724-82-1 |
|---|---|
| SMILES | C1CC2=CC=C(C3=CC=CC1=C23)NC(=S)N |
Product Overview
1,2-Dihydroacenaphthylen-5-ylthiourea (CAS 100724-82-1), with molecular formula C13H12N2S and molecular weight 228.07 g/mol. IUPAC: 1,2-dihydroacenaphthylen-5-ylthiourea.
Chemical Property Profile of 1,2-Dihydroacenaphthylen-5-ylthiourea
Property Insights of 1,2-Dihydroacenaphthylen-5-ylthiourea
The XLogP value of 2.5939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydroacenaphthylen-5-ylthiourea. With a topological polar surface area (TPSA) of 38.05 Ų, 1,2-Dihydroacenaphthylen-5-ylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dihydroacenaphthylen-5-ylthiourea 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 1,2-Dihydroacenaphthylen-5-ylthiourea?
The CAS number of 1,2-Dihydroacenaphthylen-5-ylthiourea is 100724-82-1.
What is the molecular formula of 1,2-Dihydroacenaphthylen-5-ylthiourea?
The molecular formula of 1,2-Dihydroacenaphthylen-5-ylthiourea is C13H12N2S.
What is the molecular weight of 1,2-Dihydroacenaphthylen-5-ylthiourea?
The molecular weight of 1,2-Dihydroacenaphthylen-5-ylthiourea is 228.07 g/mol.
Where can I buy 1,2-Dihydroacenaphthylen-5-ylthiourea?
You can request a quote for 1,2-Dihydroacenaphthylen-5-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihydroacenaphthylen-5-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydroacenaphthylen-5-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.