AC1MGDSZ
5-(4-methylphenyl)-2-oxo-4-sulfanyl-1,5-diazaspiro[5.5]undec-3-ene-3-carbonitrile
Also Known As: AF-399/42810493|SR-01000280788-1|1-(4-methylphenyl)-4-oxo-2-sulfanyl-1,5-diazaspiro[5.5]undec-2-ene-3-carbonitrile|5-(4-methylphenyl)-2-oxo-4-sulfanyl-1,5-diazaspiro[5.5]undec-3-ene-3-carbonitrile|1-(4-methylphenyl)-4-oxo-2-sulfanyl-1,5-diazaspiro[5.5]undec-2-ene-3-carbonitr ile|11-(4-methylphenyl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile|2-mercapto-1-(4-methylphenyl)-4-oxo-1,5-diazaspiro[5.5]undec-2-ene-3-carbonitrile
| Molecular Formula | C17H19N3OS |
|---|---|
| Molecular Weight | 313.12488 g/mol |
| LogP | 3.2566 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.12488 |
| Monoisotopic Mass | 313.12488 |
| Heavy Atoms | 22 |
| Complexity | 666.13965 |
Chemical Identifiers
| CAS Number | 708286-79-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C(=O)NC23CCCCC3)C#N)S |
Product Overview
AC1MGDSZ (CAS 708286-79-7), with molecular formula C17H19N3OS and molecular weight 313.12488 g/mol. IUPAC: 5-(4-methylphenyl)-2-oxo-4-sulfanyl-1,5-diazaspiro[5.5]undec-3-ene-3-carbonitrile.
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