BIM-0046581.P001
TL;DR: BIM-0046581.P001 (CAS 303062-79-5) is a chemical compound with molecular formula C19H18Cl5N3O4S and molecular weight 558.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[(2,4-dichlorophenyl)carbamothioylamino]ethyl]benzamide
Also Known As: BIM-0046581.P001, 3,4,5-TRIMETHOXY-N-(2,2,2-TRICHLORO-1-{[(2,4-DICHLOROANILINO)CARBOTHIOYL]AMINO}ETHYL)BENZAMIDE, 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-({[(2,4-dichlorophenyl)amino]carbonothioyl}amino)ethyl]benzamide, 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[(2,4-dichlorophenyl)carbamothioylamino]ethyl]benzamide, 3,4,5-TRIMETHOXY-N-(2,2,2-TRICHLORO-1-(((2,4-DICHLOROANILINO)CARBOTHIOYL)AMINO)ETHYL)BENZAMIDE
| Molecular Formula | C19H18Cl5N3O4S |
|---|---|
| Molecular Weight | 558.95 g/mol |
| LogP | 5.4319 |
| Topological Polar Surface Area | 80.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 558.94604 |
| Heavy Atoms | 32 |
| Complexity | 978.40894 |
Chemical Identifiers
| CAS Number | 303062-79-5 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=C(C=C(C=C2)Cl)Cl |
Product Overview
BIM-0046581.P001 (CAS 303062-79-5), with molecular formula C19H18Cl5N3O4S and molecular weight 558.95 g/mol. IUPAC: 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[(2,4-dichlorophenyl)carbamothioylamino]ethyl]benzamide.
Chemical Property Profile of BIM-0046581.P001
Property Insights of BIM-0046581.P001
The XLogP value of 5.4319 indicates that BIM-0046581.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0046581.P001. Following Lipinski's Rule of Five, BIM-0046581.P001 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0046581.P001?
The CAS number of BIM-0046581.P001 is 303062-79-5.
What is the molecular formula of BIM-0046581.P001?
The molecular formula of BIM-0046581.P001 is C19H18Cl5N3O4S.
What is the molecular weight of BIM-0046581.P001?
The molecular weight of BIM-0046581.P001 is 558.95 g/mol.
Where can I buy BIM-0046581.P001?
You can request a quote for BIM-0046581.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0046581.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0046581.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.