AC1NRG1B

1-butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxo-5-[(4-oxo-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile

Also Known As: 1-butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxo-5-[(4-oxo-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile|1-Butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxo-5-[(4-oxo-3-pentyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,2-dihydropyridine-3-carbonitrile

Molecular Formula	C26H37N5O2S2
Molecular Weight	515.2389 g/mol
LogP	4.3618
Topological Polar Surface Area	72.58 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	515.2389
Monoisotopic Mass	515.2389
Heavy Atoms	35
Complexity	1080.6838

Chemical Identifiers

CAS Number	7064-77-9
SMILES	CCCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)CCCC)N3CCN(CC3)CC)SC1=S