![2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide structure](/static/products/835/835899-49-5.png)
2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide
TL;DR: 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide (CAS 835899-49-5) is a chemical compound with molecular formula C18H17Cl2N3O2S and molecular weight 409.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide
Also Known As: AP-970/43336925, 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide, 2,4-dichloro-N-(3-{[(isobutyrylamino)carbothioyl]amino}phenyl)benzamide, 2,4-dichloro-N-(3-{[(2-methylpropanoyl)carbamothioyl]amino}phenyl)benzamide
| Molecular Formula | C18H17Cl2N3O2S |
|---|---|
| Molecular Weight | 409.04 g/mol |
| LogP | 4.7147 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.04184 |
| Heavy Atoms | 26 |
| Complexity | 856.0799 |
Chemical Identifiers
| CAS Number | 835899-49-5 |
|---|---|
| SMILES | CC(C)C(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl |
Product Overview
2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide (CAS 835899-49-5), with molecular formula C18H17Cl2N3O2S and molecular weight 409.04 g/mol. IUPAC: 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide.
Chemical Property Profile of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide
Property Insights of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide
The XLogP value of 4.7147 indicates that 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide. Following Lipinski's Rule of Five, 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide has 3 hydrogen bond donor(s) and 3 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 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide?
The CAS number of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide is 835899-49-5.
What is the molecular formula of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide?
The molecular formula of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide is C18H17Cl2N3O2S.
What is the molecular weight of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide?
The molecular weight of 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide is 409.04 g/mol.
Where can I buy 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide?
You can request a quote for 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dichloro-N-[3-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.