![(E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide structure](/static/products/799/799820-86-3.png)
(E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
TL;DR: (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide (CAS 799820-86-3) is a chemical compound with molecular formula C25H18N2O4S and molecular weight 442.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
Also Known As: (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide, N-[(9,10-dioxoanthracen-2-yl)thiocarbamoyl]-3-(4-methoxyphenyl)prop-2-enamide, (2E)-N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide, (E)-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide, N-(9,10-DIOXO-9,10-DIHYDRO-2-ANTHRACENYL)-N'-[3-(4-METHOXYPHENYL)ACRYLOYL]THIOUREA
| Molecular Formula | C25H18N2O4S |
|---|---|
| Molecular Weight | 442.10 g/mol |
| LogP | 3.997 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.09872 |
| Heavy Atoms | 32 |
| Complexity | 1279.3544 |
Chemical Identifiers
| CAS Number | 799820-86-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O |
Product Overview
(E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide (CAS 799820-86-3), with molecular formula C25H18N2O4S and molecular weight 442.10 g/mol. IUPAC: (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
Property Insights of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
The XLogP value of 3.997 indicates that (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide has 2 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 (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide?
The CAS number of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide is 799820-86-3.
What is the molecular formula of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide?
The molecular formula of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide is C25H18N2O4S.
What is the molecular weight of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide?
The molecular weight of (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide is 442.10 g/mol.
Where can I buy (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide?
You can request a quote for (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)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 (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.