Chlorambucil-spermidine conjugate

Base Information

• Chemical Name: Chlorambucil-spermidine conjugate
• CAS No.: 143984-22-9
• Molecular Formula: C₂₄H₄₃Cl₂N₅O
• Molecular Weight: 488.544
• DSSTox Substance ID: DTXSID10162587
• Wikidata: Q83031292
• Mol file: 143984-22-9.mol

Synonyms:CBSP conjugate;chlorambucil-spermidine conjugate

Chemical Property of Chlorambucil-spermidine conjugate

Chemical Property:

• Vapor Pressure: 6.7E-18mmHg at 25°C
• Boiling Point: 671.6°Cat760mmHg
• Flash Point: 360°C
• PSA: 91.11000
• Density: 1.123g/cm³
• LogP: 5.43020
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 20
• Exact Mass: 487.2844664
• Heavy Atom Count: 32
• Complexity: 444

Purity/Quality:

98.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CCCC(=O)NCCCN(CCCCN)CCCN)N(CCCl)CCCl

Technology Process of Chlorambucil-spermidine conjugate

There total 7 articles about Chlorambucil-spermidine conjugate 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:

N-(3-aminopropyl)-1,4-diaminobutane (124-20-9) → N-<3-aminopropyl>-4-phenylbutanamide (143984-22-9)

Guidance literature:

Multi-step reaction with 5 steps

1: 72 percent

3: H₂ / Raney Ni

5: H ⁽¹⁺⁾ / H₂O

With hydrogen; hydrogen cation; nickel; In water;

DOI:10.1039/c39920000298

Reference yield:

N1,N8-bis(tert-butoxycarbonyl)spermidine (83392-10-3) → N-<3-aminopropyl>-4-phenylbutanamide (143984-22-9)

Guidance literature:

Multi-step reaction with 4 steps

2: H₂ / Raney Ni

4: H ⁽¹⁺⁾ / H₂O

With hydrogen; hydrogen cation; nickel; In water;

DOI:10.1039/c39920000298

Reference yield:

{4-[(3-tert-Butoxycarbonylamino-propyl)-(2-cyano-ethyl)-amino]-butyl}-carbamic acid tert-butyl ester (207552-16-7) → N-<3-aminopropyl>-4-phenylbutanamide (143984-22-9)

Guidance literature:

Multi-step reaction with 3 steps

1: H₂ / Raney Ni

3: H ⁽¹⁺⁾ / H₂O

With hydrogen; hydrogen cation; nickel; In water;

DOI:10.1039/c39920000298

upstream raw materials:

{4-[[3-(4-{4-[Bis-(2-chloro-ethyl)-amino]-phenyl}-butyrylamino)-propyl]-(3-tert-butoxycarbonylamino-propyl)-amino]-butyl}-carbamic acid tert-butyl ester

N-(3-aminopropyl)-1,4-diaminobutane

chlorambucil chloride

N¹,N⁸-bis(tert-butoxycarbonyl)spermidine

Refernces