AC1MHN0K
[[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino]-phenylmethanesulfonic acid
Also Known As: 4(p-Chlorophenyl)-2-(alpha-sulfobenzylamino)thiazole-5-acetic acid methyl ester|Thiazole-5-acetic acid, 4-(p-chlorophenyl)-2-(alpha-sulfobenzylamino)-, methyl ester|2-Benzyl-amino-alpha-sulpho-4-p-chlorophenylthiazole-5-acetic acid methyl ester|[[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino]-phenylmethanesulfonic acid|{[4-(4-Chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino}(phenyl)methanesulfonic acid
| Molecular Formula | C19H17ClN2O5S2 |
|---|---|
| Molecular Weight | 452.02673 g/mol |
| LogP | 4.1775 |
| Topological Polar Surface Area | 105.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.02673 |
| Monoisotopic Mass | 452.02673 |
| Heavy Atoms | 29 |
| Complexity | 1099.388 |
Chemical Identifiers
| CAS Number | 71013-57-5 |
|---|---|
| SMILES | COC(=O)CC1=C(N=C(S1)NC(C2=CC=CC=C2)S(=O)(=O)O)C3=CC=C(C=C3)Cl |
Product Overview
AC1MHN0K (CAS 71013-57-5), with molecular formula C19H17ClN2O5S2 and molecular weight 452.02673 g/mol. IUPAC: [[4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]amino]-phenylmethanesulfonic acid.
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