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Benzo[b][1,8]naphthyridin-2(1H)-one
TL;DR: Benzo[b][1,8]naphthyridin-2(1H)-one (CAS 112499-49-7) is a chemical compound with molecular formula C12H8N2O and molecular weight 196.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-benzo[b][1,8]naphthyridin-2-one
Also Known As: Benzonaphthyridone, Benzo[b][1,8]naphthyridin-2(1H)-one, Benzo[b][1,8]napthyridin-2(1H)-one, 1H-benzo[b][1,8]naphthyridin-2-one, Benzo[b][1,8]naphthyridine-2(1H)-one
| Molecular Formula | C12H8N2O |
|---|---|
| Molecular Weight | 196.06 g/mol |
| LogP | 2.0763 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.06366 |
| Heavy Atoms | 15 |
| Complexity | 700.376 |
Chemical Identifiers
| CAS Number | 112499-49-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC(=O)NC3=N2 |
Product Overview
Benzo[b][1,8]naphthyridin-2(1H)-one (CAS 112499-49-7), with molecular formula C12H8N2O and molecular weight 196.06 g/mol. IUPAC: 1H-benzo[b][1,8]naphthyridin-2-one.
Chemical Property Profile of Benzo[b][1,8]naphthyridin-2(1H)-one
Property Insights of Benzo[b][1,8]naphthyridin-2(1H)-one
The XLogP value of 2.0763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo[b][1,8]naphthyridin-2(1H)-one. With a topological polar surface area (TPSA) of 45.75 Ų, Benzo[b][1,8]naphthyridin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[b][1,8]naphthyridin-2(1H)-one has 1 hydrogen bond donor(s) and 2 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 Benzo[b][1,8]naphthyridin-2(1H)-one?
The CAS number of Benzo[b][1,8]naphthyridin-2(1H)-one is 112499-49-7.
What is the molecular formula of Benzo[b][1,8]naphthyridin-2(1H)-one?
The molecular formula of Benzo[b][1,8]naphthyridin-2(1H)-one is C12H8N2O.
What is the molecular weight of Benzo[b][1,8]naphthyridin-2(1H)-one?
The molecular weight of Benzo[b][1,8]naphthyridin-2(1H)-one is 196.06 g/mol.
Where can I buy Benzo[b][1,8]naphthyridin-2(1H)-one?
You can request a quote for Benzo[b][1,8]naphthyridin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[b][1,8]naphthyridin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for Benzo[b][1,8]naphthyridin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.