25-Deacetyl 3-diethylaminomethyl rifamycin SV
TL;DR: 25-Deacetyl 3-diethylaminomethyl rifamycin SV (CAS 16783-95-2) is a chemical compound with molecular formula C40H56N2O11 and molecular weight 740.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S,9E,11S,12S,13S,14R,15R,16R,17S,18S,19E,21Z)-26-(diethylaminomethyl)-2,13,15,17,27,29-hexahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaene-6,23-dione
Also Known As: 25-Deacetyl 3-diethylaminomethyl rifamycin SV, Rifamycin, 25-O-deacetyl-3-((diethylamino)methyl)-, Rifamycin, 25-O-deacetyl-3-[(diethylamino)methyl]-, diethylaminomethyl-hexahydroxy-methoxy-heptamethyl-[?]dione, (2S,16S,17S,18R,19R,20R,21S,22S,23S)-8-[(Diethylamino)methyl]-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-2,7-(epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-1,11-dione
| Molecular Formula | C40H56N2O11 |
|---|---|
| Molecular Weight | 740.39 g/mol |
| LogP | 5.02512 |
| Topological Polar Surface Area | 198.48 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 740.3884 |
| Heavy Atoms | 53 |
| Complexity | 1799.0626 |
Chemical Identifiers
| CAS Number | 16783-95-2 |
|---|---|
| SMILES | CCN(CC)CC1=C2C(=C3C(=C1O)C4=C(C(=C3O)C)O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(\C(=O)N2)/C)C)O)C)O)C)O)C)OC)C)O |
Product Overview
25-Deacetyl 3-diethylaminomethyl rifamycin SV (CAS 16783-95-2), with molecular formula C40H56N2O11 and molecular weight 740.39 g/mol. IUPAC: (7S,9E,11S,12S,13S,14R,15R,16R,17S,18S,19E,21Z)-26-(diethylaminomethyl)-2,13,15,17,27,29-hexahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaene-6,23-dione.
Chemical Property Profile of 25-Deacetyl 3-diethylaminomethyl rifamycin SV
Property Insights of 25-Deacetyl 3-diethylaminomethyl rifamycin SV
The XLogP value of 5.02512 indicates that 25-Deacetyl 3-diethylaminomethyl rifamycin SV is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 198.48 Ų indicates high polarity, suggesting 25-Deacetyl 3-diethylaminomethyl rifamycin SV may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 25-Deacetyl 3-diethylaminomethyl rifamycin SV has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 25-Deacetyl 3-diethylaminomethyl rifamycin SV?
The CAS number of 25-Deacetyl 3-diethylaminomethyl rifamycin SV is 16783-95-2.
What is the molecular formula of 25-Deacetyl 3-diethylaminomethyl rifamycin SV?
The molecular formula of 25-Deacetyl 3-diethylaminomethyl rifamycin SV is C40H56N2O11.
What is the molecular weight of 25-Deacetyl 3-diethylaminomethyl rifamycin SV?
The molecular weight of 25-Deacetyl 3-diethylaminomethyl rifamycin SV is 740.39 g/mol.
Where can I buy 25-Deacetyl 3-diethylaminomethyl rifamycin SV?
You can request a quote for 25-Deacetyl 3-diethylaminomethyl rifamycin SV directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 25-Deacetyl 3-diethylaminomethyl rifamycin SV?
Yes, KEHONG BIO provides custom synthesis services for 25-Deacetyl 3-diethylaminomethyl rifamycin SV and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.