Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate
TL;DR: Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate (CAS 618444-01-2) is a chemical compound with molecular formula C22H16ClNO3 and molecular weight 377.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(2-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1-carboxylate
Also Known As: ETHYL 3-(2-CHLOROBENZOYL)PYRROLO(2,1-A)ISOQUINOLINE-1-CARBOXYLATE, ethyl 3-(2-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1-carboxylate
| Molecular Formula | C22H16ClNO3 |
|---|---|
| Molecular Weight | 377.08 g/mol |
| LogP | 5.1536 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.08188 |
| Heavy Atoms | 27 |
| Complexity | 1192.8358 |
Chemical Identifiers
| CAS Number | 618444-01-2 |
|---|---|
| SMILES | CCOC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1)C(=O)C4=CC=CC=C4Cl |
Product Overview
Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate (CAS 618444-01-2), with molecular formula C22H16ClNO3 and molecular weight 377.08 g/mol. IUPAC: ethyl 3-(2-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1-carboxylate.
Chemical Property Profile of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate
Property Insights of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate
The XLogP value of 5.1536 indicates that Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.78 Ų, Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate?
The CAS number of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate is 618444-01-2.
What is the molecular formula of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate?
The molecular formula of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate is C22H16ClNO3.
What is the molecular weight of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate?
The molecular weight of Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate is 377.08 g/mol.
Where can I buy Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate?
You can request a quote for Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(2-chlorobenzoyl)pyrrolo(2,1-A)isoquinoline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.