AC1MDFCQ

4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(2-phenyl-1λ4-thia-2,3,4,5-tetrazacyclopenta-3,5-dien-1-yl)-3-pyrrolidin-1-yl-4H-pyrazol-1-yl]phenyl]butanamide

Also Known As: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(2-phenyl-1|4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(2-phenyl-1$l^{4}-thia-2,3,4,5-tetrazacyclopenta-3,5-dien-1-yl)-3-pyrrolidin-1-yl-4H-pyrazol-1-yl]phenyl]butanamide|4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-{4-[5-oxo-4-(2-phenyl-2H-1$l^{4},2,3,4,5-thiatetrazol-1-yl)-3-(pyrrolidin-1-yl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl}butanamide|4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-{4-[5-oxo-4-(2-phenyl-2H-1lambda~4~,2,3,4,5-thiatetrazol-1-yl)-3-(pyrrolidin-1-yl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl}butanamide

Molecular Formula	C39H50N8O3S
Molecular Weight	710.3727 g/mol
LogP	8.5033
Topological Polar Surface Area	114.56 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	13
Exact Mass	710.3727
Monoisotopic Mass	710.3727
Heavy Atoms	51
Complexity	1817.5032

Chemical Identifiers

CAS Number	370075-93-7
SMILES	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC=C(C=C2)N3C(=O)C(C(=N3)N4CCCC4)S5=NN=NN5C6=CC=CC=C6)C(C)(C)CC