4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide
TL;DR: 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide (CAS 391896-52-9) is a chemical compound with molecular formula C27H20N2O2S and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzoyl-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)benzamide
Also Known As: 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide, 1-(4-benzoylbenzoyl)-3-(1,2-dihydroacenaphthylen-5-yl)thiourea, 4-benzoyl-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)benzamide, N-(acenaphthen-5-ylthiocarbamoyl)-4-benzoyl-benzamide, F0496-0133
| Molecular Formula | C27H20N2O2S |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 5.2962 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.12454 |
| Heavy Atoms | 32 |
| Complexity | 1351.823 |
Chemical Identifiers
| CAS Number | 391896-52-9 |
|---|---|
| SMILES | C1CC2=CC=C(C3=CC=CC1=C23)NC(=S)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5 |
Product Overview
4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide (CAS 391896-52-9), with molecular formula C27H20N2O2S and molecular weight 436.12 g/mol. IUPAC: 4-benzoyl-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)benzamide.
Chemical Property Profile of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide
Property Insights of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide
The XLogP value of 5.2962 indicates that 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide?
The CAS number of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide is 391896-52-9.
What is the molecular formula of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide?
The molecular formula of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide is C27H20N2O2S.
What is the molecular weight of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide?
The molecular weight of 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide is 436.12 g/mol.
Where can I buy 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide?
You can request a quote for 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzoyl-N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.