Tallysomycin fragment WA
TL;DR: Tallysomycin fragment WA (CAS 70518-45-5) is a chemical compound with molecular formula C37H65N11O11S2 and molecular weight 903.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-amino-6-[3-(4-aminobutylamino)propylamino]-6-oxohexyl]-2-[2-[2-(5-amino-3,4-dihydroxy-6-methyloxan-2-yl)oxy-2-[[2-[(4-amino-3-hydroxypentanoyl)amino]-3-hydroxybutanoyl]amino]-1-hydroxyethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxamide
Also Known As: Tallysomycin fragment WA, (2,4'-Bithiazole)-4-carboxamide, N-(4-amino-6-((3-((4-aminobutyl)amino)propyl)amino)-6-oxohexyl)-2'-(2-((4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy)-2-((2-((4-amino-2,4,5-trideoxy-erythro-pentonoyl)amino)-3-hydroxy-1-oxobutyl)amino)-1-hydroxyethyl)-, N-(4-Amino-6-((3-((4-aminobutyl)amino)propyl)amino)-6-oxohexyl)-2'-(2-((4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy)-2-((2-((4-amino-2,4,5-trideoxy-erythro-pentonoyl)amino)-3-hydroxy-1-oxobutyl)amino)-1-hydroxyethyl)-(2,4'-bithiazole)-4-carboxamide, N-[4-amino-6-[3-(4-aminobutylamino)propylamino]-6-oxohexyl]-2-[2-[2-(5-amino-3,4-dihydroxy-6-methyloxan-2-yl)oxy-2-[[2-[(4-amino-3-hydroxypentanoyl)amino]-3-hydroxybutanoyl]amino]-1-hydroxyethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxamide
| Molecular Formula | C37H65N11O11S2 |
|---|---|
| Molecular Weight | 903.43 g/mol |
| LogP | -5.4 |
| Topological Polar Surface Area | 434.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 27 |
| Exact Mass | 903.43066 |
| Heavy Atoms | 61 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 70518-45-5 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC(C(C2=NC(=CS2)C3=NC(=CS3)C(=O)NCCCC(CC(=O)NCCCNCCCCN)N)O)NC(=O)C(C(C)O)NC(=O)CC(C(C)N)O)O)O)N |
| InChIKey | ZFRQNKRBJQEKSA-UHFFFAOYSA-N |
Product Overview
Tallysomycin fragment WA (CAS 70518-45-5), with molecular formula C37H65N11O11S2 and molecular weight 903.43 g/mol. IUPAC: N-[4-amino-6-[3-(4-aminobutylamino)propylamino]-6-oxohexyl]-2-[2-[2-(5-amino-3,4-dihydroxy-6-methyloxan-2-yl)oxy-2-[[2-[(4-amino-3-hydroxypentanoyl)amino]-3-hydroxybutanoyl]amino]-1-hydroxyethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxamide.
Chemical Property Profile of Tallysomycin fragment WA
Property Insights of Tallysomycin fragment WA
The XLogP value of -5.4 indicates that Tallysomycin fragment WA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 434.0 Ų indicates high polarity, suggesting Tallysomycin fragment WA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tallysomycin fragment WA has 14 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tallysomycin fragment WA?
The CAS number of Tallysomycin fragment WA is 70518-45-5.
What is the molecular formula of Tallysomycin fragment WA?
The molecular formula of Tallysomycin fragment WA is C37H65N11O11S2.
What is the molecular weight of Tallysomycin fragment WA?
The molecular weight of Tallysomycin fragment WA is 903.43 g/mol.
Where can I buy Tallysomycin fragment WA?
You can request a quote for Tallysomycin fragment WA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tallysomycin fragment WA?
Yes, KEHONG BIO provides custom synthesis services for Tallysomycin fragment WA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.