Polymyxin D
TL;DR: Polymyxin D (CAS 10072-50-1) is a chemical compound with molecular formula C50H93N15O15 and molecular weight 1143.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-amino-1-[[3-hydroxy-1-[[3-hydroxy-1-oxo-1-[[6,9,18-tris(2-aminoethyl)-3,12-bis(1-hydroxyethyl)-15-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]propan-2-yl]amino]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methyloctanamide
Also Known As: Polymyxin D, RefChem:175176
| Molecular Formula | C50H93N15O15 |
|---|---|
| Molecular Weight | 1143.70 g/mol |
| LogP | -3.7 |
| Topological Polar Surface Area | 505.0 Ų |
| Hydrogen Bond Donors | 19 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 27 |
| Exact Mass | 1143.6975 |
| Heavy Atoms | 80 |
| Complexity | 2040.0 |
Chemical Identifiers
| CAS Number | 10072-50-1 |
|---|---|
| SMILES | CCC(C)CCCCC(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)NC(CO)C(=O)NC1CCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CC(C)C)C(C)O)CCN)CCN)C(C)O |
| InChIKey | ZVVRUVGEGUZQHF-UHFFFAOYSA-N |
Product Overview
Polymyxin D (CAS 10072-50-1), with molecular formula C50H93N15O15 and molecular weight 1143.70 g/mol. IUPAC: N-[4-amino-1-[[3-hydroxy-1-[[3-hydroxy-1-oxo-1-[[6,9,18-tris(2-aminoethyl)-3,12-bis(1-hydroxyethyl)-15-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]propan-2-yl]amino]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methyloctanamide.
Chemical Property Profile of Polymyxin D
Property Insights of Polymyxin D
The XLogP value of -3.7 indicates that Polymyxin D is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 505.0 Ų indicates high polarity, suggesting Polymyxin D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Polymyxin D has 19 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Polymyxin D?
The CAS number of Polymyxin D is 10072-50-1.
What is the molecular formula of Polymyxin D?
The molecular formula of Polymyxin D is C50H93N15O15.
What is the molecular weight of Polymyxin D?
The molecular weight of Polymyxin D is 1143.70 g/mol.
Where can I buy Polymyxin D?
You can request a quote for Polymyxin D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polymyxin D?
Yes, KEHONG BIO provides custom synthesis services for Polymyxin D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.