Monotrifluoroacetyl gentamicin
TL;DR: Monotrifluoroacetyl gentamicin (CAS 6326-52-9) is a chemical compound with molecular formula C23H42F3N5O8 and molecular weight 573.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[4,6-diamino-3-[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]-2,2,2-trifluoroacetamide
Also Known As: Mtfa-gentamicin, Monotrifluoroacetyl gentamicin, Methacryloylthiobenzene, N-[2-[4,6-diamino-3-[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]-2,2,2-trifluoroacetamide, 4,6-diamino-3-{[3-deoxy-4-c-methyl-3-(methylamino)pentopyranosyl]oxy}-2-hydroxycyclohexyl 2,3,4,6,7-pentadeoxy-6-(methylamino)-2-[(trifluoroacetyl)amino]heptopyranoside
| Molecular Formula | C23H42F3N5O8 |
|---|---|
| Molecular Weight | 573.30 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 573.2985 |
| Heavy Atoms | 39 |
| Complexity | 831.0 |
Chemical Identifiers
| CAS Number | 6326-52-9 |
|---|---|
| SMILES | CC(C1CCC(C(O1)OC2C(CC(C(C2O)OC3C(C(C(CO3)(C)O)NC)O)N)N)NC(=O)C(F)(F)F)NC |
| InChIKey | HTCMBMWOHKKJOC-UHFFFAOYSA-N |
Product Overview
Monotrifluoroacetyl gentamicin (CAS 6326-52-9), with molecular formula C23H42F3N5O8 and molecular weight 573.30 g/mol. IUPAC: N-[2-[4,6-diamino-3-[3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-[1-(methylamino)ethyl]oxan-3-yl]-2,2,2-trifluoroacetamide.
Chemical Property Profile of Monotrifluoroacetyl gentamicin
Property Insights of Monotrifluoroacetyl gentamicin
The XLogP value of -2.7 indicates that Monotrifluoroacetyl gentamicin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 203.0 Ų indicates high polarity, suggesting Monotrifluoroacetyl gentamicin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Monotrifluoroacetyl gentamicin has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Monotrifluoroacetyl gentamicin?
The CAS number of Monotrifluoroacetyl gentamicin is 6326-52-9.
What is the molecular formula of Monotrifluoroacetyl gentamicin?
The molecular formula of Monotrifluoroacetyl gentamicin is C23H42F3N5O8.
What is the molecular weight of Monotrifluoroacetyl gentamicin?
The molecular weight of Monotrifluoroacetyl gentamicin is 573.30 g/mol.
Where can I buy Monotrifluoroacetyl gentamicin?
You can request a quote for Monotrifluoroacetyl gentamicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monotrifluoroacetyl gentamicin?
Yes, KEHONG BIO provides custom synthesis services for Monotrifluoroacetyl gentamicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.