![2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide structure](/static/products/7082/708294-36-4.webp)
2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide
TL;DR: 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide (CAS 708294-36-4) is a chemical compound with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide
Also Known As: 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide, N-[(2-methyl-5-nitrophenyl)carbamothioyl]-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
| Molecular Formula | C20H25N3O3S |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 4.32272 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.16165 |
| Heavy Atoms | 27 |
| Complexity | 772.3775 |
Chemical Identifiers
| CAS Number | 708294-36-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3 |
Product Overview
2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide (CAS 708294-36-4), with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol. IUPAC: 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide.
Chemical Property Profile of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide
Property Insights of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide
The XLogP value of 4.32272 indicates that 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide. Following Lipinski's Rule of Five, 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide has 2 hydrogen bond donor(s) and 4 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 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide?
The CAS number of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide is 708294-36-4.
What is the molecular formula of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide?
The molecular formula of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide is C20H25N3O3S.
What is the molecular weight of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide?
The molecular weight of 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide is 387.16 g/mol.
Where can I buy 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide?
You can request a quote for 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-adamantyl)-N-[(2-methyl-5-nitrophenyl)carbamothioyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.