CJ-15161 (free base)
TL;DR: CJ-15161 (free base) (CAS 204970-97-8) is a chemical compound with molecular formula C23H31N3O2 and molecular weight 381.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(1S)-2-[(3S)-3-hydroxypyrrolidin-1-yl]-1-phenylethyl]-methylamino]-N-propylbenzamide
Also Known As: CJ-15161 (free base), 4-(((S)-2-((S)-3-Hydroxypyrrolidin-1-yl)-1-phenylethyl)(methyl)amino)-N-propylbenzamide, J1.770.409E, Benzamide, 4-(((1S)-2-((3S)-3-hydroxy-1-pyrrolidinyl)-1-phenylethyl)methylamino)-N-propyl-, 4-[[(1S)-2-[(3S)-3-hydroxypyrrolidin-1-yl]-1-phenylethyl]-methylamino]-N-propylbenzamide
| Molecular Formula | C23H31N3O2 |
|---|---|
| Molecular Weight | 381.24 g/mol |
| LogP | 3.0705 |
| Topological Polar Surface Area | 55.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.24164 |
| Heavy Atoms | 28 |
| Complexity | 748.2026 |
Chemical Identifiers
| CAS Number | 204970-97-8 |
|---|---|
| SMILES | CCCNC(=O)C1=CC=C(C=C1)N(C)[C@H](CN2CC[C@@H](C2)O)C3=CC=CC=C3 |
Product Overview
CJ-15161 (free base) (CAS 204970-97-8), with molecular formula C23H31N3O2 and molecular weight 381.24 g/mol. IUPAC: 4-[[(1S)-2-[(3S)-3-hydroxypyrrolidin-1-yl]-1-phenylethyl]-methylamino]-N-propylbenzamide.
Chemical Property Profile of CJ-15161 (free base)
Property Insights of CJ-15161 (free base)
The XLogP value of 3.0705 indicates that CJ-15161 (free base) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.81 Ų, CJ-15161 (free base) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CJ-15161 (free base) 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 CJ-15161 (free base)?
The CAS number of CJ-15161 (free base) is 204970-97-8.
What is the molecular formula of CJ-15161 (free base)?
The molecular formula of CJ-15161 (free base) is C23H31N3O2.
What is the molecular weight of CJ-15161 (free base)?
The molecular weight of CJ-15161 (free base) is 381.24 g/mol.
Where can I buy CJ-15161 (free base)?
You can request a quote for CJ-15161 (free base) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CJ-15161 (free base)?
Yes, KEHONG BIO provides custom synthesis services for CJ-15161 (free base) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.