AC1MFR2E
N-benzhydryl-2-[[5-[(2-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide
Also Known As: N-benzhydryl-2-[[5-[(2-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide|N-(diphenylmethyl)-2-({5-[(2-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide
CAS: 690667-87-9
| Molecular Formula | C29H30N4O2S |
|---|---|
| Molecular Weight | 498.20895 g/mol |
| LogP | 5.73792 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 498.20895 |
| Monoisotopic Mass | 498.20895 |
| Heavy Atoms | 36 |
| Complexity | 1251.6492 |
Chemical Identifiers
| CAS Number | 690667-87-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC2=NN=C(N2CC=C)SC(C)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
AC1MFR2E (CAS 690667-87-9), with molecular formula C29H30N4O2S and molecular weight 498.20895 g/mol. IUPAC: N-benzhydryl-2-[[5-[(2-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide.
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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