2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone
TL;DR: 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone (CAS 35211-17-7) is a chemical compound with molecular formula C18H17N3O2 and molecular weight 307.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(pyridin-4-ylmethylamino)ethylamino]naphthalene-1,4-dione
Also Known As: 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone, 2-[2-(pyridin-4-ylmethylamino)ethylamino]naphthalene-1,4-dione, 2-((2-[(4-Pyridinylmethyl)amino]ethyl)amino)naphthoquinone #, 2-[(2-{[(Pyridin-4-yl)methyl]amino}ethyl)amino]naphthalene-1,4-dione
| Molecular Formula | C18H17N3O2 |
|---|---|
| Molecular Weight | 307.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.13208 |
| Heavy Atoms | 23 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 35211-17-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(C2=O)NCCNCC3=CC=NC=C3 |
| InChIKey | ORWPAVVGEQOCJK-UHFFFAOYSA-N |
Product Overview
2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone (CAS 35211-17-7), with molecular formula C18H17N3O2 and molecular weight 307.13 g/mol. IUPAC: 2-[2-(pyridin-4-ylmethylamino)ethylamino]naphthalene-1,4-dione.
Chemical Property Profile of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone
Property Insights of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone. Following Lipinski's Rule of Five, 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone has 2 hydrogen bond donor(s) and 5 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-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone?
The CAS number of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone is 35211-17-7.
What is the molecular formula of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone?
The molecular formula of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone is C18H17N3O2.
What is the molecular weight of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone?
The molecular weight of 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone is 307.13 g/mol.
Where can I buy 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone?
You can request a quote for 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-[(4-Pyridylmethyl)amino]ethyl]amino]-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.