AC1LXTST
N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-methoxybenzamide
Also Known As: BAS 14602184|BRD-K44478009-001-01-0|N-{5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-1H-1,2,4-triazol-3-yl}-4-methoxybenzamide|N-(5-((benzo[d]thiazol-2-ylthio)methyl)-1H-1,2,4-triazol-3-yl)-4-methoxybenzamide|N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-methoxybenzamide|N-[5-(benzothiazol-2-ylthiomethyl)(1H-1,2,4-triazol-3-yl)](4-methoxyphenyl)car boxamide
| Molecular Formula | C18H15N5O2S2 |
|---|---|
| Molecular Weight | 397.0667 g/mol |
| LogP | 3.9676 |
| Topological Polar Surface Area | 92.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.0667 |
| Monoisotopic Mass | 397.0667 |
| Heavy Atoms | 27 |
| Complexity | 1041.7577 |
Chemical Identifiers
| CAS Number | 810686-76-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NC2=NNC(=N2)CSC3=NC4=CC=CC=C4S3 |
Product Overview
AC1LXTST (CAS 810686-76-1), with molecular formula C18H15N5O2S2 and molecular weight 397.0667 g/mol. IUPAC: N-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-1H-1,2,4-triazol-3-yl]-4-methoxybenzamide.
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