methyl}naphthalene-1,4-dione structure](/static/products/6629/6629-19-2.webp)
2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione
TL;DR: 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione (CAS 6629-19-2) is a chemical compound with molecular formula C19H17NO3 and molecular weight 307.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(dimethylamino)phenyl]-hydroxymethyl]naphthalene-1,4-dione
Also Known As: NCIOpen2_007466, 2-{[4-(dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione, 2-[(4-dimethylaminophenyl)-hydroxymethyl]naphthalene-1,4-dione, 2-[(4-dimethylaminophenyl)-hydroxy-methyl]naphthalene-1,4-dione, 2-[[4-(dimethylamino)phenyl]-hydroxymethyl]naphthalene-1,4-dione
| Molecular Formula | C19H17NO3 |
|---|---|
| Molecular Weight | 307.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.12085 |
| Heavy Atoms | 23 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 6629-19-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(C2=CC(=O)C3=CC=CC=C3C2=O)O |
| InChIKey | SOHBBNNFCYTYIL-UHFFFAOYSA-N |
Product Overview
2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione (CAS 6629-19-2), with molecular formula C19H17NO3 and molecular weight 307.12 g/mol. IUPAC: 2-[[4-(dimethylamino)phenyl]-hydroxymethyl]naphthalene-1,4-dione.
Chemical Property Profile of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione
Property Insights of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione. With a topological polar surface area (TPSA) of 57.6 Ų, 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione 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 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione?
The CAS number of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione is 6629-19-2.
What is the molecular formula of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione?
The molecular formula of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione is C19H17NO3.
What is the molecular weight of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione?
The molecular weight of 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione is 307.12 g/mol.
Where can I buy 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione?
You can request a quote for 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(Dimethylamino)phenyl](hydroxy)methyl}naphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.