ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate
TL;DR: ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate (CAS 956340-02-6) is a chemical compound with molecular formula C22H29N3O3 and molecular weight 383.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate
Also Known As: ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate, (S)-ethyl 2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate, ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate
| Molecular Formula | C22H29N3O3 |
|---|---|
| Molecular Weight | 383.22 g/mol |
| LogP | 3.8466 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.2209 |
| Heavy Atoms | 28 |
| Complexity | 884.27936 |
Chemical Identifiers
| CAS Number | 956340-02-6 |
|---|---|
| SMILES | CCOC(=O)[C@@]1(C2=C(CCN1C(=O)NC3CCCCC3)C4=CC=CC=C4N2)C |
Product Overview
ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate (CAS 956340-02-6), with molecular formula C22H29N3O3 and molecular weight 383.22 g/mol. IUPAC: ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate.
Chemical Property Profile of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate
Property Insights of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate
The XLogP value of 3.8466 indicates that ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate. Following Lipinski's Rule of Five, ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate has 2 hydrogen bond donor(s) and 3 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 ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate?
The CAS number of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate is 956340-02-6.
What is the molecular formula of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate?
The molecular formula of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate is C22H29N3O3.
What is the molecular weight of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate?
The molecular weight of ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate is 383.22 g/mol.
Where can I buy ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate?
You can request a quote for ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-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 (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (1S)-2-(cyclohexylcarbamoyl)-1-methyl-2,3,4,9-tetrahydro-1H-beta-carboline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.