AC1NK62Y
4-[[3-[(2-methoxyphenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-4-oxobutanoic acid
Also Known As: (Z)-4-((3-(2-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid|4-[[3-[(2-methoxyphenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-4-oxobutanoic acid|4-{[(2Z)-3-(2-methoxybenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoic acid
| Molecular Formula | C17H20N2O6S2 |
|---|---|
| Molecular Weight | 412.0763 g/mol |
| LogP | 1.157 |
| Topological Polar Surface Area | 113.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.0763 |
| Monoisotopic Mass | 412.0763 |
| Heavy Atoms | 27 |
| Complexity | 883.16473 |
Chemical Identifiers
| CAS Number | 900893-55-2 |
|---|---|
| SMILES | COC1=CC=CC=C1CN2C3CS(=O)(=O)CC3SC2=NC(=O)CCC(=O)O |
Product Overview
AC1NK62Y (CAS 900893-55-2), with molecular formula C17H20N2O6S2 and molecular weight 412.0763 g/mol. IUPAC: 4-[[3-[(2-methoxyphenyl)methyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-4-oxobutanoic acid.
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