D05QCE
methyl 4-[(5-fluoro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylbenzoate
Also Known As: Chymase inhibitors (cardiovascular disease)|J2.036.742C|Chymase inhibitors (cardiovascular disease), Toa Eiyo|methyl 4-(5-fluoro-3-methylbenzo[b]thiophene-2-sulfonylamino)-3-methanesulfonylbenzoate|methyl 4-(5-fluoro-3-methyl-1-benzothiophene-2-sulfonamido)-3-methanesulfonylbenzoate|Methyl 4-[(5-fluoro-3-methyl-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonyl-benzoate|3-(Methylsulfonyl)-4-(3-methyl-5-fluorobenzo[b]thiophene-2-ylsulfonylamino)benzoic acid methyl ester|4-(5-Fluoro-3-methyl-benzo[b]thiophene-2-sulfonylamino)-3-methanesulfonyl-benzoic acid methyl ester
| Molecular Formula | C18H16FNO6S3 |
|---|---|
| Molecular Weight | 457.0124 g/mol |
| LogP | 3.33972 |
| Topological Polar Surface Area | 106.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.0124 |
| Monoisotopic Mass | 457.0124 |
| Heavy Atoms | 29 |
| Complexity | 1343.4187 |
Chemical Identifiers
| CAS Number | 404963-90-2 |
|---|---|
| SMILES | CC1=C(SC2=C1C=C(C=C2)F)S(=O)(=O)NC3=C(C=C(C=C3)C(=O)OC)S(=O)(=O)C |
Product Overview
D05QCE (CAS 404963-90-2), with molecular formula C18H16FNO6S3 and molecular weight 457.0124 g/mol. IUPAC: methyl 4-[(5-fluoro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-3-methylsulfonylbenzoate.
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