N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide
TL;DR: N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide (CAS 425678-94-0) is a chemical compound with molecular formula C20H24N2OS and molecular weight 340.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-butan-2-ylphenyl)carbamothioyl]-3,4-dimethylbenzamide
Also Known As: N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide, N-[(4-butan-2-ylphenyl)carbamothioyl]-3,4-dimethylbenzamide
| Molecular Formula | C20H24N2OS |
|---|---|
| Molecular Weight | 340.16 g/mol |
| LogP | 4.94374 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.16095 |
| Heavy Atoms | 24 |
| Complexity | 737.80414 |
Chemical Identifiers
| CAS Number | 425678-94-0 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)C)C |
Product Overview
N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide (CAS 425678-94-0), with molecular formula C20H24N2OS and molecular weight 340.16 g/mol. IUPAC: N-[(4-butan-2-ylphenyl)carbamothioyl]-3,4-dimethylbenzamide.
Chemical Property Profile of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide
Property Insights of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide
The XLogP value of 4.94374 indicates that N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide 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-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide 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-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide?
The CAS number of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide is 425678-94-0.
What is the molecular formula of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide?
The molecular formula of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide is C20H24N2OS.
What is the molecular weight of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide?
The molecular weight of N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide is 340.16 g/mol.
Where can I buy N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide?
You can request a quote for N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[4-(butan-2-yl)phenyl]carbamothioyl}-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.