N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide
TL;DR: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide (CAS 425679-73-8) is a chemical compound with molecular formula C20H15IN2OS and molecular weight 458.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide
Also Known As: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide, N-(acenaphthen-5-ylthiocarbamoyl)-3-iodo-benzamide, N-[(acenaphthen-5-ylamino)thioxomethyl](3-iodophenyl)carboxamide, N-[(1,2-dihydroacenaphthylen-5-ylamino)carbonothioyl]-3-iodobenzamide
| Molecular Formula | C20H15IN2OS |
|---|---|
| Molecular Weight | 458.00 g/mol |
| LogP | 4.6698 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 457.995 |
| Heavy Atoms | 25 |
| Complexity | 1005.49884 |
Chemical Identifiers
| CAS Number | 425679-73-8 |
|---|---|
| SMILES | C1CC2=CC=C(C3=CC=CC1=C23)NC(=S)NC(=O)C4=CC(=CC=C4)I |
Product Overview
N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide (CAS 425679-73-8), with molecular formula C20H15IN2OS and molecular weight 458.00 g/mol. IUPAC: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide.
Chemical Property Profile of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide
Property Insights of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide
The XLogP value of 4.6698 indicates that N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide 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 N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide?
The CAS number of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide is 425679-73-8.
What is the molecular formula of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide?
The molecular formula of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide is C20H15IN2OS.
What is the molecular weight of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide?
The molecular weight of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide is 458.00 g/mol.
Where can I buy N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide?
You can request a quote for N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.