Leucinamide-beta-carboline-3-carboxylate methyl ester
TL;DR: Leucinamide-beta-carboline-3-carboxylate methyl ester (CAS 110672-77-0) is a chemical compound with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-4-methyl-2-(9H-pyrido[3,4-b]indole-3-carbonylamino)pentanoate
Also Known As: Leu-b-ccme, Leucinamide-beta-carboline-3-carboxylate methyl ester, methyl (2S)-4-methyl-2-(9H-pyrido[3,4-b]indole-3-carbonylamino)pentanoate, methyl N-(9H-beta-carbolin-3-ylcarbonyl)-L-leucinate, L-Leucine, N-(9H-pyrido(3,4-b)indol-3-ylcarbonyl)-, methyl ester
| Molecular Formula | C19H21N3O3 |
|---|---|
| Molecular Weight | 339.16 g/mol |
| LogP | 3.0336 |
| Topological Polar Surface Area | 84.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.1583 |
| Heavy Atoms | 25 |
| Complexity | 929.9598 |
Chemical Identifiers
| CAS Number | 110672-77-0 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)OC)NC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2 |
Product Overview
Leucinamide-beta-carboline-3-carboxylate methyl ester (CAS 110672-77-0), with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol. IUPAC: methyl (2S)-4-methyl-2-(9H-pyrido[3,4-b]indole-3-carbonylamino)pentanoate.
Chemical Property Profile of Leucinamide-beta-carboline-3-carboxylate methyl ester
Property Insights of Leucinamide-beta-carboline-3-carboxylate methyl ester
The XLogP value of 3.0336 indicates that Leucinamide-beta-carboline-3-carboxylate methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Leucinamide-beta-carboline-3-carboxylate methyl ester. Following Lipinski's Rule of Five, Leucinamide-beta-carboline-3-carboxylate methyl ester 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 Leucinamide-beta-carboline-3-carboxylate methyl ester?
The CAS number of Leucinamide-beta-carboline-3-carboxylate methyl ester is 110672-77-0.
What is the molecular formula of Leucinamide-beta-carboline-3-carboxylate methyl ester?
The molecular formula of Leucinamide-beta-carboline-3-carboxylate methyl ester is C19H21N3O3.
What is the molecular weight of Leucinamide-beta-carboline-3-carboxylate methyl ester?
The molecular weight of Leucinamide-beta-carboline-3-carboxylate methyl ester is 339.16 g/mol.
Where can I buy Leucinamide-beta-carboline-3-carboxylate methyl ester?
You can request a quote for Leucinamide-beta-carboline-3-carboxylate methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Leucinamide-beta-carboline-3-carboxylate methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Leucinamide-beta-carboline-3-carboxylate methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.