RefChem:1055951
TL;DR: RefChem:1055951 (CAS 6525-13-9) is a chemical compound with molecular formula C23H32ClNO2 and molecular weight 389.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-naphthalen-1-yl-5-piperidin-1-ium-1-yl-2-propan-2-ylpentanoic acid chloride
Also Known As: 1-Naphthaleneacetic acid, alpha-isopropyl-alpha-(3-piperidinopropyl)-, hydrochloride, alpha-Isopropyl-alpha-(3-piperidinopropyl)-1-naphthaleneacetic acid hydrochloride, 2-Naphthalen-1-yl-5-piperidin-1-ium-1-yl-2-propan-2-ylpentanoic acidchloride, 1-Piperidinevaleric acid, .alpha.-isopropyl-.alpha.-1-naphthyl-, hydrochloride, 2-naphthalen-1-yl-5-piperidin-1-ium-1-yl-2-propan-2-ylpentanoic acid chloride
| Molecular Formula | C23H32ClNO2 |
|---|---|
| Molecular Weight | 389.21 g/mol |
| LogP | 0.67 |
| Topological Polar Surface Area | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.21216 |
| Heavy Atoms | 27 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 6525-13-9 |
|---|---|
| SMILES | CC(C)C(CCC[NH+]1CCCCC1)(C2=CC=CC3=CC=CC=C32)C(=O)O.[Cl-] |
| InChIKey | MVOZKCGANZDCNJ-UHFFFAOYSA-N |
Product Overview
RefChem:1055951 (CAS 6525-13-9), with molecular formula C23H32ClNO2 and molecular weight 389.21 g/mol. IUPAC: 2-naphthalen-1-yl-5-piperidin-1-ium-1-yl-2-propan-2-ylpentanoic acid chloride.
Chemical Property Profile of RefChem:1055951
Property Insights of RefChem:1055951
The XLogP value of 0.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1055951. With a topological polar surface area (TPSA) of 41.7 Ų, RefChem:1055951 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1055951 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 RefChem:1055951?
The CAS number of RefChem:1055951 is 6525-13-9.
What is the molecular formula of RefChem:1055951?
The molecular formula of RefChem:1055951 is C23H32ClNO2.
What is the molecular weight of RefChem:1055951?
The molecular weight of RefChem:1055951 is 389.21 g/mol.
Where can I buy RefChem:1055951?
You can request a quote for RefChem:1055951 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1055951?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1055951 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.