D-Proline, 1-(4-(1,1-dimethylethyl)-3-methoxybenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(2-thiazolyl)-, (4R,5S)-rel-

Base Information

• Chemical Name: D-Proline, 1-(4-(1,1-dimethylethyl)-3-methoxybenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(2-thiazolyl)-, (4R,5S)-rel-
• CAS No.: 885264-71-1
• Molecular Formula: C26H32 N4 O5 S
• Molecular Weight: 0
• UNII: 2YAD6KT0NT
• ChEMBL ID: CHEMBL2024212
• Wikidata: Q27255804
• Mol file: 885264-71-1.mol

Synonyms:GSK-625433;UNII-2YAD6KT0NT;2YAD6KT0NT;885264-71-1;GSK625433;D-Proline, 1-(4-(1,1-dimethylethyl)-3-methoxybenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(2-thiazolyl)-, (4R,5S)-rel-;(2R,4S,5R)-1-(4-tert-butyl-3-methoxybenzoyl)-4-(methoxymethyl)-2-(pyrazol-1-ylmethyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid;(2R,4S,5R)-1-(4-tert-butyl-3-methoxy-benzoyl)-4-(methoxymethyl)-2-(pyrazol-1-ylmethyl)-5-thiazol-2-yl-pyrrolidine-2-carboxylic acid;SCHEMBL5186945;CHEMBL2024212;AKOS040748484;Q27255804;(2R,4S,5R)-1-(3-Methoxy-4-tert-butylbenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid;rel-(2R,4S,5R)-1-(3-Methoxy-4-tert-butylbenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2-carboxylic acid;rel-(2R,4S,5R)-2-((1H-Pyrazol-1-yl)methyl)-1-(4-(tert-butyl)-3-methoxybenzoyl)-4-(methoxymethyl)-5-(thiazol-2-yl)pyrrolidine-2-carboxylic acid

Chemical Property of D-Proline, 1-(4-(1,1-dimethylethyl)-3-methoxybenzoyl)-4-(methoxymethyl)-2-(1H-pyrazol-1-ylmethyl)-5-(2-thiazolyl)-, (4R,5S)-rel-

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 512.20934131
• Heavy Atom Count: 36
• Complexity: 795

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C(C(CC2(CN3C=CC=N3)C(=O)O)COC)C4=NC=CS4)OC
• Isomeric SMILES: CC(C)(C)C1=C(C=C(C=C1)C(=O)N2[C@H]([C@H](C[C@@]2(CN3C=CC=N3)C(=O)O)COC)C4=NC=CS4)OC
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