AC1NRF7Z

5-[[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-[4-(4-fluorophenyl)piperazin-1-yl]-4-methyl-2-oxo-1-propylpyridine-3-carbonitrile

Also Known As: 5-({3-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-4-methyl-2-oxo-1-propyl-1,2-dihydropyridine-3-carbonitrile|5-[[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-[4-(4-fluorophenyl)piperazin-1-yl]-4-methyl-2-oxo-1-propylpyridine-3-carbonitrile

Molecular Formula	C32H30FN5O4S2
Molecular Weight	631.1723 g/mol
LogP	5.0342
Topological Polar Surface Area	91.04 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	631.1723
Monoisotopic Mass	631.1723
Heavy Atoms	44
Complexity	1775.0054

Chemical Identifiers

CAS Number	7064-54-2
SMILES	CCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC3=CC4=C(C=C3)OCO4)N5CCN(CC5)C6=CC=C(C=C6)F