CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester

Base Information

• Chemical Name: CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester
• CAS No.: 209984-33-8
• Molecular Formula: C23H27N3O4
• Molecular Weight: 409.47818
• Mol file: 209984-33-8.mol

Synonyms:CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester

Chemical Property of CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester

Chemical Property:

• Boiling Point: 706.2±60.0 °C(Predicted)
• PKA: 11.32±0.46(Predicted)
• PSA: 87.74000
• Density: 1.24±0.1 g/cm3(Predicted)
• LogP: 4.24730

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester

There total 3 articles about CarbaMic acid, [(1S)-2-[[(7S)-6,7-dihydro-5-Methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]aMino]-1-Methyl-2-oxoethyl]-, 1,1-diMethylethyl ester 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:

7-amino-5-methyl-5H-dibenzo[b,d]azepin-6(7H)-one hydrochloride (209984-32-7) + L-N-Boc-Ala (15761-38-3) → (S)-5-(N-Boc-L-alaninyl)amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (209984-33-8) + (R)-5-(N-Boc-L-alaninyl)amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (209984-34-9)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In tetrahydrofuran; at 0 ℃; for 17h;

Reference yield:

L-N-Boc-Ala (15761-38-3) + 7-amino-5-methyl-5H-dibenzo[b,d]azepin-6(7H)-one hydrochloride (213024-76-1) → (S)-5-(N-Boc-L-alaninyl)amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (209984-33-8) + (R)-5-(N-Boc-L-alaninyl)amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (209984-34-9)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In tetrahydrofuran; at 0 ℃; for 17h;

Reference yield:

(S)-5-amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (365242-16-6) + L-N-Boc-Ala (15761-38-3) → (S)-5-(N-Boc-L-alaninyl)amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one (209984-33-8)

Guidance literature:

With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In tetrahydrofuran; at 20 ℃;

DOI:10.1016/j.bmcl.2007.07.062

upstream raw materials:

7-amino-5-methyl-5H-dibenzo[b,d]azepin-6(7H)-one hydrochloride

L-N-Boc-Ala

(S)-5-amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one

7-amino-5-methyl-5H-dibenzo[b,d]azepin-6(7H)-one hydrochloride

Downstream raw materials:

7-(S)-(L-alaninyl)-amino-5-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one