Frangulanine
TL;DR: Frangulanine (CAS 25350-22-5) is a chemical compound with molecular formula C28H44N4O4 and molecular weight 500.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2-(dimethylamino)-3-methyl-N-[(3S,4S,7S,10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]pentanamide
Also Known As: Frangulanine, (2S,3S)-2-(Dimethylamino)-3-methyl-N-[(3S,4S,7S,10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]pentanamide, (2S,3S)-2-(dimethylamino)-N-[(2Z,6S,9S,10S)-6-isobutyl-10-isopropyl-5,8-dioxo-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-3-methyl-pentanamide, (2S,3S)-2-(dimethylamino)-3-methyl-N-[(2Z,6S,9S,10S)-6-(2-methylpropyl)-5,8-dioxo-10-propan-2-yl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]pentanamide, Pentanamide, 2-(dimethylamino)-3-methyl-N-[3-(1-methylethyl)-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-, [3R-[3R*,4S*(2S*,3S*),7S*]]-
| Molecular Formula | C28H44N4O4 |
|---|---|
| Molecular Weight | 500.34 g/mol |
| LogP | 3.1825 |
| Topological Polar Surface Area | 99.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 500.33624 |
| Heavy Atoms | 36 |
| Complexity | 910.6297 |
Chemical Identifiers
| CAS Number | 25350-22-5 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@H]1[C@@H](OC2=CC=C(C=C2)/C=C\NC(=O)[C@@H](NC1=O)CC(C)C)C(C)C)N(C)C |
Product Overview
Frangulanine (CAS 25350-22-5), with molecular formula C28H44N4O4 and molecular weight 500.34 g/mol. IUPAC: (2S,3S)-2-(dimethylamino)-3-methyl-N-[(3S,4S,7S,10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]pentanamide.
Chemical Property Profile of Frangulanine
Property Insights of Frangulanine
The XLogP value of 3.1825 indicates that Frangulanine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Frangulanine. Following Lipinski's Rule of Five, Frangulanine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Frangulanine?
The CAS number of Frangulanine is 25350-22-5.
What is the molecular formula of Frangulanine?
The molecular formula of Frangulanine is C28H44N4O4.
What is the molecular weight of Frangulanine?
The molecular weight of Frangulanine is 500.34 g/mol.
Where can I buy Frangulanine?
You can request a quote for Frangulanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Frangulanine?
Yes, KEHONG BIO provides custom synthesis services for Frangulanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.