![N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide structure](/static/products/791/791789-35-0.png)
N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide
TL;DR: N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide (CAS 791789-35-0) is a chemical compound with molecular formula C14H20N2O3S and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide
Also Known As: N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide, AN-329/41162486, N-(2,5-dimethoxyphenyl)-N'-(3-methylbutanoyl)thiourea, N-{[(2,5-dimethoxyphenyl)amino]carbonothioyl}-3-methylbutanamide
| Molecular Formula | C14H20N2O3S |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 2.5629 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.11948 |
| Heavy Atoms | 20 |
| Complexity | 489.3074 |
Chemical Identifiers
| CAS Number | 791789-35-0 |
|---|---|
| SMILES | CC(C)CC(=O)NC(=S)NC1=C(C=CC(=C1)OC)OC |
Product Overview
N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide (CAS 791789-35-0), with molecular formula C14H20N2O3S and molecular weight 296.12 g/mol. IUPAC: N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide.
Chemical Property Profile of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide
Property Insights of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide
The XLogP value of 2.5629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide. With a topological polar surface area (TPSA) of 59.59 Ų, N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide 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 N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide?
The CAS number of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide is 791789-35-0.
What is the molecular formula of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide?
The molecular formula of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide is C14H20N2O3S.
What is the molecular weight of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide?
The molecular weight of N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide is 296.12 g/mol.
Where can I buy N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide?
You can request a quote for N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,5-dimethoxyphenyl)carbamothioyl]-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.