[1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate
TL;DR: [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate (CAS 91523-56-7) is a chemical compound with molecular formula C30H41N3O5 and molecular weight 523.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate
Also Known As: [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate|(8-Methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinoline-1,2-diyl)bis(methylene) bis(cyclohexylcarbamate)|Carbamic acid, (5,6-dihydro-8-methoxy-3-methylpyrrolo[2,1-a]isoquinolne-1,2-diyl)bis(methylene) ester
| Molecular Formula | C30H41N3O5 |
|---|---|
| Molecular Weight | 523.30 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 523.3046 |
| Heavy Atoms | 38 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 91523-56-7 |
|---|---|
| SMILES | CC1=C(C(=C2N1CCC3=C2C=CC(=C3)OC)COC(=O)NC4CCCCC4)COC(=O)NC5CCCCC5 |
| InChIKey | RFVUMDWSSNSEIM-UHFFFAOYSA-N |
Product Overview
[1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate (CAS 91523-56-7), with molecular formula C30H41N3O5 and molecular weight 523.30 g/mol. IUPAC: [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate.
Chemical Property Profile of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate
Property Insights of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate
The XLogP value of 5.3 indicates that [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate. Following Lipinski's Rule of Five, [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate has 2 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 [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate?
The CAS number of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate is 91523-56-7.
What is the molecular formula of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate?
The molecular formula of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate is C30H41N3O5.
What is the molecular weight of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate?
The molecular weight of [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate is 523.30 g/mol.
Where can I buy [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate?
You can request a quote for [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [1-(cyclohexylcarbamoyloxymethyl)-8-methoxy-3-methyl-5,6-dihydropyrrolo[2,1-a]isoquinolin-2-yl]methyl N-cyclohexylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.