Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate | CAS No. 1137026-67-5

Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate

Basic Information

CAS Number

1137026-67-5

Molecular Formula

C38H45N5O7

Molecular Weight

683.81 g/mol

AD

Basic Physical Properties

Solubility

Insuluble (6.5E-3 g/L) (25 ºC),

Cc1cc(cc(c1C[C@@H](C(=O)N(Cc2ccc(c(c2)C(=O)OC)OC)[C@@H](C)c3[nH]c(cn3)c4ccccc4)NC(=O)OC(C)(C)C)C)C(=O)N

InChI

InChI=1S/C38H45N5O7/c1-22-16-27(33(39)44)17-23(2)28(22)19-30(42-37(47)50-38(4,5)6)35(45)43(21-25-14-15-32(48-7)29(18-25)36(46)49-8)24(3)34-40-20-31(41-34)26-12-10-9-11-13-26/h9-18,20,24,30H,19,21H2,1-8H3,(H2,39,44)(H,40,41)(H,42,47)/t24-,30-/m0/s1

InChIKey

GWDHGKMDWNQPCN-NGQVCNFZSA-N

LogP

5.813440000000004

Topological Polar Surface Area

165.94000000000003 Ų

Hydrogen Bond Donor/Acceptor

4 / 12

Complexity

1140

Synonyms & References

English

  • Benzoic acid, 5-[[[(2S)-3-[4-(aminocarbonyl)-2,6-dimethylphenyl]-2-[[(1,1-dimethylethoxy)carbonyl]amino]-1-oxopropyl][(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino]methyl]-2-methoxy-, methyl ester
  • Methyl 5-(((S)-2-((tert-butoxycarbonyl)amino)-3-(4-carbamoyl-2,6-dimethylphenyl)-N-((S)-1-(4-phenyl-1H-imidazol-2-yl)ethyl)propanamido)methyl)-2-methoxybenzoate
  • Methyl 5-[[[3-(4-carbamoyl-2,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]-[

MDL Number

MFCD28964020

FAQ

What is Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate (CAS: 1137026-67-5)?

Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate is a complex organic compound. This molecule contains multiple functional groups such as carboxylic acid, amide, and benzene rings. It is primarily used in pharmaceutical applications and research due to its unique chemical structure.

What are the main uses of Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate (CAS: 1137026-67-5)?

Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate is used in pharmaceutical research for developing potential drug candidates. It also serves as a valuable reagent in organic synthesis and as a substrate in various biochemical assays.

Is Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate (CAS: 1137026-67-5) safe?

Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate is generally safe when handled with appropriate precautions. Users should wear personal protective equipment, such as gloves and goggles, to avoid skin and eye contact. Storage in a cool, dry place away from direct sunlight is recommended.

How should Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate (CAS: 1137026-67-5) be stored?

Methyl 5-({(4-carbamoyl-2,6-dimethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanyl)[(1S)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]amino}methyl)-2-methoxybenzoate should be stored in a tightly sealed container at a temperature not exceeding 25°C and away from direct sunlight to prevent degradation. Optimal storage conditions include a cool, dry environment to maintain its stability and potency.

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