Rifamycin B methylpropylamide

Base Information

• Chemical Name: Rifamycin B methylpropylamide
• CAS No.: 16784-10-4
• Molecular Formula: C₄₃H₅₈N₂O₁₃
• Molecular Weight: 810.939
• Mol file: 16784-10-4.mol

Synonyms:Rifamycin B methylpropylamide;NCI 143-427;BRN 5418339;16784-10-4;NSC143427;4-O-[2-(Methylpropylamino)-2-oxoethyl]rifamycin;Acetamide, 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-methyl-N-propyl-, 21-acetate;Rifamycin, 4-O-(2-(methylpropylamino)-2-oxoethyl)-;[(9E,19E,21E)-2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-27-[2-[methyl(propyl)amino]-2-oxoethoxy]-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;Rifamycin, 4-O-[2-(methylpropylamino)-2-oxoethyl]-;[tetrahydroxy-methoxy-heptamethyl-[2-[methyl(propyl)amino]-2-oxo-ethoxy]-dioxo-[?]yl] acetate;LS-9242;Acetamide, 2-[[(14E)-21-(acetyloxy)-1,2-dihydro-5,6,17,19-tetrahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-2,7-(epoxy[1,11,13]pentadecatrienoimino)naphtho[2,1-b]furan-9-yl]oxy]-N-methyl-N-propyl-

Chemical Property of Rifamycin B methylpropylamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 927.4°C at 760 mmHg
• PKA: 4.96±0.70(Predicted)
• Flash Point: 514.7°C
• PSA: 214.11000
• Density: 1.3g/cm³
• LogP: 5.38080
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 810.39388991
• Heavy Atom Count: 58
• Complexity: 1550

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN(C)C(=O)COC1=C2C3=C(C(=C1)NC(=O)C(=CC=CC(C(C(C(C(C(C(C(C=COC4(C(=O)C2=C(O4)C(=C3O)C)C)OC)C)OC(=O)C)C)O)C)O)C)C)O
• Isomeric SMILES: CCCN(C)C(=O)COC1=C2C3=C(C(=C1)NC(=O)/C(=C/C=C/C(C(C(C(C(C(C(C(/C=C/OC4(C(=O)C2=C(O4)C(=C3O)C)C)OC)C)OC(=O)C)C)O)C)O)C)/C)O

Technology Process of Rifamycin B methylpropylamide

There total 1 articles about Rifamycin B methylpropylamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

methyl-n-propylamine (627-35-0) + Rifamycin B (13929-35-6) → Rifamycin-B- (16784-10-4)

Guidance literature:

With dicyclohexyl-carbodiimide; In tetrahydrofuran;

DOI:10.1021/jm00335a005

upstream raw materials:

methyl-n-propylamine

Rifamycin B