![2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide structure](/static/products/6978/6978-75-2.webp)
2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide
TL;DR: 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide (CAS 6978-75-2) is a chemical compound with molecular formula C25H23N3O4S and molecular weight 461.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide
Also Known As: 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide, 2-({[3-(3,4-Dimethoxyphenyl)prop-2-enoyl]carbamothioyl}amino)-N-phenylbenzamide, 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylthiocarbamoylamino]-N-phenyl-benzamide
| Molecular Formula | C25H23N3O4S |
|---|---|
| Molecular Weight | 461.14 g/mol |
| LogP | 4.4825 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.14093 |
| Heavy Atoms | 33 |
| Complexity | 1179.2794 |
Chemical Identifiers
| CAS Number | 6978-75-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3)OC |
Product Overview
2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide (CAS 6978-75-2), with molecular formula C25H23N3O4S and molecular weight 461.14 g/mol. IUPAC: 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide.
Chemical Property Profile of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide
Property Insights of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide
The XLogP value of 4.4825 indicates that 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide. Following Lipinski's Rule of Five, 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide has 3 hydrogen bond donor(s) and 5 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-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide?
The CAS number of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide is 6978-75-2.
What is the molecular formula of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide?
The molecular formula of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide is C25H23N3O4S.
What is the molecular weight of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide?
The molecular weight of 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide is 461.14 g/mol.
Where can I buy 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide?
You can request a quote for 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-N-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.