AC1NF8R9
ethyl 4-[[2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: Oprea1_695812|F0417-0488|ethyl 4-[2-({5-[4-(pyrrolidine-1-sulfonyl)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate|ethyl 4-(2-((5-(4-(pyrrolidin-1-ylsulfonyl)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetamido)benzoate|ethyl 4-[[2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C24H25N5O6S3 |
|---|---|
| Molecular Weight | 575.0967 g/mol |
| LogP | 3.4824 |
| Topological Polar Surface Area | 147.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 575.0967 |
| Monoisotopic Mass | 575.0967 |
| Heavy Atoms | 38 |
| Complexity | 1402.0576 |
Chemical Identifiers
| CAS Number | 392294-75-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4 |
Product Overview
AC1NF8R9 (CAS 392294-75-6), with molecular formula C24H25N5O6S3 and molecular weight 575.0967 g/mol. IUPAC: ethyl 4-[[2-[[5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate.
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