Kahalalide F
TL;DR: Kahalalide F (CAS 149204-42-2) is a chemical compound with molecular formula C75H124N14O16 and molecular weight 1476.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-amino-1-[[1-[[9-benzyl-15-butan-2-yl-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-1-[2-[[2-[[3-hydroxy-2-[[3-methyl-2-(5-methylhexanoylamino)butanoyl]amino]butanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide
Also Known As: Kahalalide F, N-[5-amino-1-[[1-[[9-benzyl-15-butan-2-yl-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-1-[2-[[2-[[3-hydroxy-2-[[3-methyl-2-(5-methylhexanoylamino)butanoyl]amino]butanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide
| Molecular Formula | C75H124N14O16 |
|---|---|
| Molecular Weight | 1476.93 g/mol |
| LogP | 1.8364 |
| Topological Polar Surface Area | 442.06 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 33 |
| Exact Mass | 1476.932 |
| Heavy Atoms | 105 |
| Complexity | 3159.9426 |
Chemical Identifiers
| CAS Number | 149204-42-2 |
|---|---|
| SMILES | CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(=CC)C(=O)NC(C(=O)OC(C(C(=O)N1)NC(=O)C(C(C)CC)NC(=O)C(CCCN)NC(=O)C2CCCN2C(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)O)NC(=O)C(C(C)C)NC(=O)CCCC(C)C)C)C(C)C)CC3=CC=CC=C3)C(C)C |
Product Overview
Kahalalide F (CAS 149204-42-2), with molecular formula C75H124N14O16 and molecular weight 1476.93 g/mol. IUPAC: N-[5-amino-1-[[1-[[9-benzyl-15-butan-2-yl-6-ethylidene-19-methyl-2,5,8,11,14,17-hexaoxo-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]-1-[2-[[2-[[3-hydroxy-2-[[3-methyl-2-(5-methylhexanoylamino)butanoyl]amino]butanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of Kahalalide F
Property Insights of Kahalalide F
The XLogP value of 1.8364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Kahalalide F. The TPSA of 442.06 Ų indicates high polarity, suggesting Kahalalide F may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Kahalalide F has 14 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Kahalalide F?
The CAS number of Kahalalide F is 149204-42-2.
What is the molecular formula of Kahalalide F?
The molecular formula of Kahalalide F is C75H124N14O16.
What is the molecular weight of Kahalalide F?
The molecular weight of Kahalalide F is 1476.93 g/mol.
Where can I buy Kahalalide F?
You can request a quote for Kahalalide F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kahalalide F?
Yes, KEHONG BIO provides custom synthesis services for Kahalalide F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.