4-cyclohexaneamido-N-({[(3-methylphenyl)formamido]methanethioyl}amino)benzamide

4-cyclohexaneamido-N-({[(3-methylphenyl)formamido]methanethioyl}amino)benzamide

Formula: C23H26N4O3S

SMILES: CC1=CC(=CC=C1)C(=O)NC(=S)NNC(=O)C1=CC=C(NC(=O)C2CCCCC2)C=C1

IUPAC: 4-cyclohexaneamido-N-({[(3-methylphenyl)formamido]methanethioyl}amino)benzamide

InChI: InChI=1S/C23H26N4O3S/c1-15-6-5-9-18(14-15)21(29)25-23(31)27-26-22(30)17-10-12-19(13-11-17)24-20(28)16-7-3-2-4-8-16/h5-6,9-14,16H,2-4,7-8H2,1H3,(H,24,28)(H,26,30)(H2,25,27,29,31)

Composition: C (62.99%), H (5.98%), N (12.78%), O (10.94%), S (7.31%)

Molar Mass: 438.55

Atom Count: 57

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	438.172561887
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	4
InChIKey	FAOUGYXKFKAHPG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	126.01
Topological Polar Surface Area	99.33
Polarizability	47.13
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H26N4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00