CAS 5591-03-7 - C17H19Cl2N3O2
TL;DR: CAS 5591-03-7 - C17H19Cl2N3O2 (CAS 5591-03-7) is a chemical compound with molecular formula C17H19Cl2N3O2 and molecular weight 367.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[N-(2,3-dichloroanilino)-C-methylcarbonimidoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
| Molecular Formula | C17H19Cl2N3O2 |
|---|---|
| Molecular Weight | 367.09 g/mol |
| LogP | 4.95114 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.08542 |
| Heavy Atoms | 24 |
| Complexity | 797.3736 |
Chemical Identifiers
| CAS Number | 5591-03-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(N1)C)C(=NNC2=C(C(=CC=C2)Cl)Cl)C)C |
Product Overview
CAS 5591-03-7 - C17H19Cl2N3O2 (CAS 5591-03-7), with molecular formula C17H19Cl2N3O2 and molecular weight 367.09 g/mol. IUPAC: ethyl 4-[N-(2,3-dichloroanilino)-C-methylcarbonimidoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate.
Chemical Property Profile of CAS 5591-03-7 - C17H19Cl2N3O2
Property Insights of CAS 5591-03-7 - C17H19Cl2N3O2
The XLogP value of 4.95114 indicates that CAS 5591-03-7 - C17H19Cl2N3O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 5591-03-7 - C17H19Cl2N3O2. Following Lipinski's Rule of Five, CAS 5591-03-7 - C17H19Cl2N3O2 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 CAS 5591-03-7 - C17H19Cl2N3O2?
The CAS number of CAS 5591-03-7 - C17H19Cl2N3O2 is 5591-03-7.
What is the molecular formula of CAS 5591-03-7 - C17H19Cl2N3O2?
The molecular formula of CAS 5591-03-7 - C17H19Cl2N3O2 is C17H19Cl2N3O2.
What is the molecular weight of CAS 5591-03-7 - C17H19Cl2N3O2?
The molecular weight of CAS 5591-03-7 - C17H19Cl2N3O2 is 367.09 g/mol.
Where can I buy CAS 5591-03-7 - C17H19Cl2N3O2?
You can request a quote for CAS 5591-03-7 - C17H19Cl2N3O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 5591-03-7 - C17H19Cl2N3O2?
Yes, KEHONG BIO provides custom synthesis services for CAS 5591-03-7 - C17H19Cl2N3O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.