AC1MSITC
3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-fluorophenyl)imino-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
Also Known As: (2Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-fluorophenyl)imino]-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide|(Z)-3-(3,4-dimethoxyphenethyl)-2-((2-fluorophenyl)imino)-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide|3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-fluorophenyl)imino-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide
| Molecular Formula | C27H26FN3O4S |
|---|---|
| Molecular Weight | 507.1628 g/mol |
| LogP | 5.0459 |
| Topological Polar Surface Area | 80.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.1628 |
| Monoisotopic Mass | 507.1628 |
| Heavy Atoms | 36 |
| Complexity | 1268.8834 |
Chemical Identifiers
| CAS Number | 522650-15-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CC(SC2=NC3=CC=CC=C3F)C(=O)NC4=CC=CC=C4)OC |
Product Overview
AC1MSITC (CAS 522650-15-3), with molecular formula C27H26FN3O4S and molecular weight 507.1628 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-fluorophenyl)imino-4-oxo-N-phenyl-1,3-thiazinane-6-carboxamide.
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