![N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide structure](/static/products/6978/6978-74-1.webp)
N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
TL;DR: N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide (CAS 6978-74-1) is a chemical compound with molecular formula C18H17BrN2O3S and molecular weight 420.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-bromophenyl)carbamothioyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Also Known As: N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide, N-[(4-bromophenyl)carbamothioyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
| Molecular Formula | C18H17BrN2O3S |
|---|---|
| Molecular Weight | 420.01 g/mol |
| LogP | 3.9927 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.01434 |
| Heavy Atoms | 25 |
| Complexity | 791.4082 |
Chemical Identifiers
| CAS Number | 6978-74-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)Br)OC |
Product Overview
N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide (CAS 6978-74-1), with molecular formula C18H17BrN2O3S and molecular weight 420.01 g/mol. IUPAC: N-[(4-bromophenyl)carbamothioyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide.
Chemical Property Profile of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
Property Insights of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
The XLogP value of 3.9927 indicates that N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide 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-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide?
The CAS number of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide is 6978-74-1.
What is the molecular formula of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide?
The molecular formula of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide is C18H17BrN2O3S.
What is the molecular weight of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide?
The molecular weight of N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide is 420.01 g/mol.
Where can I buy N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide?
You can request a quote for N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-bromophenyl)thiocarbamoyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.