AC1NM5EL
5-[[3-(2-iodophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-5-oxopentanoic acid
Also Known As: (Z)-5-((3-(2-iodophenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-5-oxopentanoic acid|5-[[3-(2-iodophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-5-oxopentanoic acid|5-{[(2Z)-3-(2-iodophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoic acid
| Molecular Formula | C16H17IN2O5S2 |
|---|---|
| Molecular Weight | 507.96237 g/mol |
| LogP | 2.1475 |
| Topological Polar Surface Area | 104.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 507.96237 |
| Monoisotopic Mass | 507.96237 |
| Heavy Atoms | 26 |
| Complexity | 871.146 |
Chemical Identifiers
| CAS Number | 900287-99-2 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)SC(=NC(=O)CCCC(=O)O)N2C3=CC=CC=C3I |
Product Overview
AC1NM5EL (CAS 900287-99-2), with molecular formula C16H17IN2O5S2 and molecular weight 507.96237 g/mol. IUPAC: 5-[[3-(2-iodophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-5-oxopentanoic acid.
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