[1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1
TL;DR: [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 (CAS 91523-60-3) is a chemical compound with molecular formula C21H27N3O4 and molecular weight 385.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-ethylcarbamate
Also Known As: [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1|[1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-ethylcarbamate|(3-Methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1,2-diyl)bis(methylene) bis(ethylcarbamate)|Carbamic acid, (5,6-dihydro-3-methylpyrrolo[2,1-a]isoquinoline-1,2-diyl)bis(methylene) ester
| Molecular Formula | C21H27N3O4 |
|---|---|
| Molecular Weight | 385.20 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 81.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 385.20016 |
| Heavy Atoms | 28 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 91523-60-3 |
|---|---|
| SMILES | CCNC(=O)OCC1=C(N2CCC3=CC=CC=C3C2=C1COC(=O)NCC)C |
| InChIKey | HXEJBYVMMKSTKF-UHFFFAOYSA-N |
Product Overview
[1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 (CAS 91523-60-3), with molecular formula C21H27N3O4 and molecular weight 385.20 g/mol. IUPAC: [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-ethylcarbamate.
Chemical Property Profile of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1
Property Insights of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1. The TPSA of 81.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1. Following Lipinski's Rule of Five, [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 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 [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1?
The CAS number of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 is 91523-60-3.
What is the molecular formula of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1?
The molecular formula of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 is C21H27N3O4.
What is the molecular weight of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1?
The molecular weight of [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 is 385.20 g/mol.
Where can I buy [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1?
You can request a quote for [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1?
Yes, KEHONG BIO provides custom synthesis services for [1-(ethylcarbamoyloxymethyl)-3-methyl-5,6-dihydropyrrolo[2,1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.