5-Thiazolecarboxylic acid, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2-phenyl-, ethyl ester, (S)-

Base Information

• Chemical Name: 5-Thiazolecarboxylic acid, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2-phenyl-, ethyl ester, (S)-
• CAS No.: 70547-30-7
• Molecular Formula: C₁₉H₂₆N₂O₄S
• Molecular Weight: 378.492
• ChEMBL ID: CHEMBL3085285
• DSSTox Substance ID: DTXSID101110936
• Mol file: 70547-30-7.mol

Synonyms:CHEMBL3085285;SCHEMBL11377271;DTXSID101110936;5-Thiazolecarboxylic acid, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2-phenyl-, ethyl ester, (S)-;70547-30-7

Chemical Property of 5-Thiazolecarboxylic acid, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2-phenyl-, ethyl ester, (S)-

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 378.16132849
• Heavy Atom Count: 26
• Complexity: 438

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)OCC(CNC(C)(C)C)O
• Isomeric SMILES: CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)OC[C@H](CNC(C)(C)C)O