纳布嗪
TL;DR: 纳布嗪 (CAS 119630-94-3) is a chemical compound with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
纳布嗪
N-[(4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ylidene)amino]benzamide
Also Known As: Nalbzoh, Naloxone benzoylhydrazone, N-[(4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ylidene)amino]benzamide, N-[(4a,9-Dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ylidene)amino]benzamide
| Molecular Formula | C26H27N3O4 |
|---|---|
| Molecular Weight | 445.20 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 94.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.20016 |
| Heavy Atoms | 33 |
| Complexity | 841.0 |
Chemical Identifiers
| CAS Number | 119630-94-3 |
|---|---|
| SMILES | C=CCN1CCC23C4C(=NNC(=O)C5=CC=CC=C5)CCC2(C1CC6=C3C(=C(C=C6)O)O4)O |
| InChIKey | AKXCFAYOTIEFOH-UHFFFAOYSA-N |
Product Overview
纳布嗪 (CAS 119630-94-3), with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol. IUPAC: N-[(4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ylidene)amino]benzamide.
Chemical Property Profile of 纳布嗪
Property Insights of 纳布嗪
The XLogP value of 3.5 indicates that 纳布嗪 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 纳布嗪. Following Lipinski's Rule of Five, 纳布嗪 has 3 hydrogen bond donor(s) and 6 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 纳布嗪?
The CAS number of 纳布嗪 is 119630-94-3.
What is the molecular formula of 纳布嗪?
The molecular formula of 纳布嗪 is C26H27N3O4.
What is the molecular weight of 纳布嗪?
The molecular weight of 纳布嗪 is 445.20 g/mol.
Where can I buy 纳布嗪?
You can request a quote for 纳布嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 纳布嗪?
Yes, KEHONG BIO provides custom synthesis services for 纳布嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.