3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol
TL;DR: 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol (CAS 16236-13-8) is a chemical compound with molecular formula C16H18N2O2 and molecular weight 270.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxynaphthalen-2-yl)-(4-methylpiperazin-1-yl)methanone
Also Known As: 3-[(4-methylpiperazin-1-yl)carbonyl]-2-naphthol, (3-hydroxynaphthalen-2-yl)(4-methylpiperazin-1-yl)methanone, 3-(4-METHYLPIPERAZINE-1-CARBONYL)NAPHTHALEN-2-OL, (3-hydroxynaphthalen-2-yl)-(4-methylpiperazin-1-yl)methanone, 3-(4-Methylpiperazin-1-yl)carbonyl-2-naphthol
| Molecular Formula | C16H18N2O2 |
|---|---|
| Molecular Weight | 270.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.13684 |
| Heavy Atoms | 20 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 16236-13-8 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C=C2O |
| InChIKey | UCEUFIKLKSGMQB-UHFFFAOYSA-N |
Product Overview
3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol (CAS 16236-13-8), with molecular formula C16H18N2O2 and molecular weight 270.14 g/mol. IUPAC: (3-hydroxynaphthalen-2-yl)-(4-methylpiperazin-1-yl)methanone.
Chemical Property Profile of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol
Property Insights of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol. With a topological polar surface area (TPSA) of 43.8 Ų, 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol has 1 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 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol?
The CAS number of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol is 16236-13-8.
What is the molecular formula of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol?
The molecular formula of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol is C16H18N2O2.
What is the molecular weight of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol?
The molecular weight of 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol is 270.14 g/mol.
Where can I buy 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol?
You can request a quote for 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.