Benzosampangine
TL;DR: Benzosampangine (CAS 62887-53-0) is a chemical compound with molecular formula C19H10N2O and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,12-diazapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-1,3,5,7,9(21),10,12,14,16,18-decaen-20-one
Also Known As: BENZOSAMPANGINE, benzo-sampangine, 13-Deazaascididemin, Benzo(4,5)sampangine, N-8-Deazaascididemin
| Molecular Formula | C19H10N2O |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 282.0793 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 62887-53-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=NC=CC4=C3C(=NC5=CC=CC=C45)C2=O |
| InChIKey | SGZVAGOBRALNLJ-UHFFFAOYSA-N |
Product Overview
Benzosampangine (CAS 62887-53-0), with molecular formula C19H10N2O and molecular weight 282.08 g/mol. IUPAC: 2,12-diazapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-1,3,5,7,9(21),10,12,14,16,18-decaen-20-one.
Chemical Property Profile of Benzosampangine
Property Insights of Benzosampangine
The XLogP value of 3.9 indicates that Benzosampangine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.9 Ų, Benzosampangine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzosampangine has 0 hydrogen bond donor(s) and 3 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 Benzosampangine?
The CAS number of Benzosampangine is 62887-53-0.
What is the molecular formula of Benzosampangine?
The molecular formula of Benzosampangine is C19H10N2O.
What is the molecular weight of Benzosampangine?
The molecular weight of Benzosampangine is 282.08 g/mol.
Where can I buy Benzosampangine?
You can request a quote for Benzosampangine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzosampangine?
Yes, KEHONG BIO provides custom synthesis services for Benzosampangine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.