Rugulosuvine B
TL;DR: Rugulosuvine B (CAS 144606-96-2) is a chemical compound with molecular formula C27H29N3O3 and molecular weight 443.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-acetyl-4-benzyl-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Also Known As: Rugulosuvine B, Puberulin, Fructigenine A, acetyl-benzyl-(1,1-dimethylallyl)[?]dione, 16-Acetyl-4-benzyl-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
| Molecular Formula | C27H29N3O3 |
|---|---|
| Molecular Weight | 443.22 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.2209 |
| Heavy Atoms | 33 |
| Complexity | 848.0 |
Chemical Identifiers
| CAS Number | 144606-96-2 |
|---|---|
| SMILES | CC(=O)N1C2C(CC3N2C(=O)C(NC3=O)CC4=CC=CC=C4)(C5=CC=CC=C51)C(C)(C)C=C |
| InChIKey | UHFSGFDEMVYYRX-UHFFFAOYSA-N |
Product Overview
Rugulosuvine B (CAS 144606-96-2), with molecular formula C27H29N3O3 and molecular weight 443.22 g/mol. IUPAC: 16-acetyl-4-benzyl-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione.
Chemical Property Profile of Rugulosuvine B
Property Insights of Rugulosuvine B
The XLogP value of 4.1 indicates that Rugulosuvine B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Rugulosuvine B. Following Lipinski's Rule of Five, Rugulosuvine B has 1 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 Rugulosuvine B?
The CAS number of Rugulosuvine B is 144606-96-2.
What is the molecular formula of Rugulosuvine B?
The molecular formula of Rugulosuvine B is C27H29N3O3.
What is the molecular weight of Rugulosuvine B?
The molecular weight of Rugulosuvine B is 443.22 g/mol.
Where can I buy Rugulosuvine B?
You can request a quote for Rugulosuvine B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rugulosuvine B?
Yes, KEHONG BIO provides custom synthesis services for Rugulosuvine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.