(S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide
TL;DR: (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide (CAS 1173674-61-7) is a chemical compound with molecular formula C22H33N3O4S and molecular weight 435.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]-N-(2-methylpropyl)pyrrolidine-2-carboxamide
Also Known As: (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide
| Molecular Formula | C22H33N3O4S |
|---|---|
| Molecular Weight | 435.22 g/mol |
| LogP | 2.15892 |
| Topological Polar Surface Area | 86.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.21918 |
| Heavy Atoms | 30 |
| Complexity | 858.8738 |
Chemical Identifiers
| CAS Number | 1173674-61-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC[C@H]3C(=O)NCC(C)C |
Product Overview
(S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide (CAS 1173674-61-7), with molecular formula C22H33N3O4S and molecular weight 435.22 g/mol. IUPAC: (2S)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]-N-(2-methylpropyl)pyrrolidine-2-carboxamide.
Chemical Property Profile of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide
Property Insights of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide
The XLogP value of 2.15892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide. The TPSA of 86.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide. Following Lipinski's Rule of Five, (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide has 1 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 (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide?
The CAS number of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide is 1173674-61-7.
What is the molecular formula of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide?
The molecular formula of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide is C22H33N3O4S.
What is the molecular weight of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide?
The molecular weight of (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide is 435.22 g/mol.
Where can I buy (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide?
You can request a quote for (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (S)-N-isobutyl-1-(1-tosylpiperidine-4-carbonyl)pyrrolidine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.