![1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid structure](/static/products/117/1173682-84-2.png)
1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid
TL;DR: 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid (CAS 1173682-84-2) is a chemical compound with molecular formula C21H26ClN3O4 and molecular weight 419.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2S)-2-[(5-chloro-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]piperidine-4-carboxylic acid
Also Known As: 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid, (S)-1-(2-(5-chloro-1-methyl-1H-indole-2-carboxamido)-3-methylbutanoyl)piperidine-4-carboxylic acid, 1-[(2S)-2-[(5-chloro-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]piperidine-4-carboxylic acid, 1-[2-[(5-chloro-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]piperidine-4-carboxylic Acid
| Molecular Formula | C21H26ClN3O4 |
|---|---|
| Molecular Weight | 419.16 g/mol |
| LogP | 2.9093 |
| Topological Polar Surface Area | 91.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.1612 |
| Heavy Atoms | 29 |
| Complexity | 944.79443 |
Chemical Identifiers
| CAS Number | 1173682-84-2 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N1CCC(CC1)C(=O)O)NC(=O)C2=CC3=C(N2C)C=CC(=C3)Cl |
Product Overview
1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid (CAS 1173682-84-2), with molecular formula C21H26ClN3O4 and molecular weight 419.16 g/mol. IUPAC: 1-[(2S)-2-[(5-chloro-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]piperidine-4-carboxylic acid.
Chemical Property Profile of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid
Property Insights of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid
The XLogP value of 2.9093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid. The TPSA of 91.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid 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 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid?
The CAS number of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid is 1173682-84-2.
What is the molecular formula of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid?
The molecular formula of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid is C21H26ClN3O4.
What is the molecular weight of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid?
The molecular weight of 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid is 419.16 g/mol.
Where can I buy 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid?
You can request a quote for 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-{N-[(5-chloro-1-methyl-1H-indol-2-yl)carbonyl]-L-valyl}piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.