Rifamycin B cyclopentylmethylamide
TL;DR: Rifamycin B cyclopentylmethylamide (CAS 17607-41-9) is a chemical compound with molecular formula C45H60N2O13 and molecular weight 836.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(9E,19E,21E)-27-[2-[cyclopentyl(methyl)amino]-2-oxoethoxy]-2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate
Also Known As: Rifamycin B cyclopentylmethylamide, NCI 173-428, Rifamycin, 4-O-(2-(cyclopentylmethylamino)-2-oxoethyl)-, Rifamycin, 4-O-[2-(cyclopentylmethylamino)-2-oxoethyl]-, N-Cyclopentyl-2-((1,2-dihydro-5,6,17,19,21-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-2,7-(epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-9-yl)oxy)-N-methylacetamide 21-acetate
| Molecular Formula | C45H60N2O13 |
|---|---|
| Molecular Weight | 836.41 g/mol |
| LogP | 5.82832 |
| Topological Polar Surface Area | 210.62 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 836.40955 |
| Heavy Atoms | 60 |
| Complexity | 2070.8303 |
Chemical Identifiers
| CAS Number | 17607-41-9 |
|---|---|
| SMILES | CC1/C=C/C=C(/C(=O)NC2=CC(=C3C(=C2O)C(=C(C4=C3C(=O)C(O4)(O/C=C/C(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)OCC(=O)N(C)C5CCCC5)\C |
Product Overview
Rifamycin B cyclopentylmethylamide (CAS 17607-41-9), with molecular formula C45H60N2O13 and molecular weight 836.41 g/mol. IUPAC: [(9E,19E,21E)-27-[2-[cyclopentyl(methyl)amino]-2-oxoethoxy]-2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate.
Chemical Property Profile of Rifamycin B cyclopentylmethylamide
Property Insights of Rifamycin B cyclopentylmethylamide
The XLogP value of 5.82832 indicates that Rifamycin B cyclopentylmethylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 210.62 Ų indicates high polarity, suggesting Rifamycin B cyclopentylmethylamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Rifamycin B cyclopentylmethylamide has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Rifamycin B cyclopentylmethylamide?
The CAS number of Rifamycin B cyclopentylmethylamide is 17607-41-9.
What is the molecular formula of Rifamycin B cyclopentylmethylamide?
The molecular formula of Rifamycin B cyclopentylmethylamide is C45H60N2O13.
What is the molecular weight of Rifamycin B cyclopentylmethylamide?
The molecular weight of Rifamycin B cyclopentylmethylamide is 836.41 g/mol.
Where can I buy Rifamycin B cyclopentylmethylamide?
You can request a quote for Rifamycin B cyclopentylmethylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rifamycin B cyclopentylmethylamide?
Yes, KEHONG BIO provides custom synthesis services for Rifamycin B cyclopentylmethylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.