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N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide
TL;DR: N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide (CAS 425677-52-7) is a chemical compound with molecular formula C16H15FN2O3S and molecular weight 334.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide
Also Known As: N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide, AB00107296-01
| Molecular Formula | C16H15FN2O3S |
|---|---|
| Molecular Weight | 334.08 g/mol |
| LogP | 2.9697 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.07874 |
| Heavy Atoms | 23 |
| Complexity | 737.0153 |
Chemical Identifiers
| CAS Number | 425677-52-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)F)OC |
Product Overview
N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide (CAS 425677-52-7), with molecular formula C16H15FN2O3S and molecular weight 334.08 g/mol. IUPAC: N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide.
Chemical Property Profile of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide
Property Insights of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide
The XLogP value of 2.9697 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide. With a topological polar surface area (TPSA) of 59.59 Ų, N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide 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-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide?
The CAS number of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide is 425677-52-7.
What is the molecular formula of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide?
The molecular formula of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide is C16H15FN2O3S.
What is the molecular weight of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide?
The molecular weight of N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide is 334.08 g/mol.
Where can I buy N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide?
You can request a quote for N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.