尼博霉素
TL;DR: 尼博霉素 (CAS 6282-68-4) is a chemical compound with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼博霉素
6-(hydroxymethyl)-3,10-dimethyl-15-oxa-3,13-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2(7),5,8,10-pentaene-4,12-dione
Also Known As: Nybomycin, Nybomycin derivative, NYBOMYCIN [MI], hydroxymethyl(dimethyl)[?]dione, NCI60_004922
| Molecular Formula | C16H14N2O4 |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.09537 |
| Heavy Atoms | 22 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 6282-68-4 |
|---|---|
| SMILES | CC1=CC(=O)N2COC3=C2C1=CC4=C3N(C(=O)C=C4CO)C |
| InChIKey | HKMUGCUFXWTNSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尼博霉素 (CAS 6282-68-4), with molecular formula C16H14N2O4 and molecular weight 298.10 g/mol. IUPAC: 6-(hydroxymethyl)-3,10-dimethyl-15-oxa-3,13-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2(7),5,8,10-pentaene-4,12-dione.
Chemical Property Profile of 尼博霉素
Property Insights of 尼博霉素
The XLogP value of -0.5 indicates that 尼博霉素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 尼博霉素. Following Lipinski's Rule of Five, 尼博霉素 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 尼博霉素?
The CAS number of 尼博霉素 is 6282-68-4.
What is the molecular formula of 尼博霉素?
The molecular formula of 尼博霉素 is C16H14N2O4.
What is the molecular weight of 尼博霉素?
The molecular weight of 尼博霉素 is 298.10 g/mol.
Where can I buy 尼博霉素?
You can request a quote for 尼博霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼博霉素?
Yes, KEHONG BIO provides custom synthesis services for 尼博霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.