C18H13IN4O
3-[(E)-(3-iodophenyl)methylideneamino]-8-methyl-5H-pyrimido[5,4-b]indol-4-one
Also Known As: (E)-3-((3-iodobenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one|3-{[(E)-(3-iodophenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
CAS: 372155-46-9
| Molecular Formula | C18H13IN4O |
|---|---|
| Molecular Weight | 428.0134 g/mol |
| LogP | 3.67302 |
| Topological Polar Surface Area | 63.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 428.0134 |
| Monoisotopic Mass | 428.0134 |
| Heavy Atoms | 24 |
| Complexity | 1156.8209 |
Chemical Identifiers
| CAS Number | 372155-46-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)/N=C/C4=CC(=CC=C4)I |
Product Overview
C18H13IN4O (CAS 372155-46-9), with molecular formula C18H13IN4O and molecular weight 428.0134 g/mol. IUPAC: 3-[(E)-(3-iodophenyl)methylideneamino]-8-methyl-5H-pyrimido[5,4-b]indol-4-one.
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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