N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
TL;DR: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide (CAS 333739-75-6) is a chemical compound with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
Also Known As: BAS 02820202, N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide, 1-Acenaphthen-5-yl-3-(4-methoxy-benzoyl)-thiourea, N-((1,2-dihydroacenaphthylen-5-yl)carbamothioyl)-4-methoxybenzamide, N-(1,2-dihydro-5-acenaphthylenyl)-N'-(4-methoxybenzoyl)thiourea
| Molecular Formula | C21H18N2O2S |
|---|---|
| Molecular Weight | 362.11 g/mol |
| LogP | 4.0738 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.1089 |
| Heavy Atoms | 26 |
| Complexity | 1002.1949 |
Chemical Identifiers
| CAS Number | 333739-75-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C3CCC4=C3C2=CC=C4 |
Product Overview
N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide (CAS 333739-75-6), with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol. IUPAC: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide.
Chemical Property Profile of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
Property Insights of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide
The XLogP value of 4.0738 indicates that N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide has 2 hydrogen bond donor(s) and 3 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)-4-methoxybenzamide?
The CAS number of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide is 333739-75-6.
What is the molecular formula of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide?
The molecular formula of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide is C21H18N2O2S.
What is the molecular weight of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide?
The molecular weight of N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide is 362.11 g/mol.
Where can I buy N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide?
You can request a quote for N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide 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)-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.