AC1MGI5X
2-[3-[[1-(3,4-dichlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetic acid
Also Known As: 3-[[1-(3,4-Dichlorophenyl)tetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene]methyl]-1H-indole-1-acetic acid|2-[3-[[1-(3,4-dichlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetic acid
CAS: 677764-91-9
| Molecular Formula | C21H13Cl2N3O4S |
|---|---|
| Molecular Weight | 473.0004 g/mol |
| LogP | 3.864 |
| Topological Polar Surface Area | 91.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.0004 |
| Monoisotopic Mass | 473.0004 |
| Heavy Atoms | 31 |
| Complexity | 1315.1971 |
Chemical Identifiers
| CAS Number | 677764-91-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CC(=O)O)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=C(C=C4)Cl)Cl |
Product Overview
AC1MGI5X (CAS 677764-91-9), with molecular formula C21H13Cl2N3O4S and molecular weight 473.0004 g/mol. IUPAC: 2-[3-[[1-(3,4-dichlorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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