N-[3-({[(4-butoxyphenyl)formamido]methanethioyl}amino)phenyl]-2-chlorobenzamide

N-[3-({[(4-butoxyphenyl)formamido]methanethioyl}amino)phenyl]-2-chlorobenzamide

Formula: C25H24ClN3O3S

SMILES: CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC1=CC=CC(NC(=O)C2=CC=CC=C2Cl)=C1

IUPAC: N-[3-({[(4-butoxyphenyl)formamido]methanethioyl}amino)phenyl]-2-chlorobenzamide

InChI: InChI=1S/C25H24ClN3O3S/c1-2-3-15-32-20-13-11-17(12-14-20)23(30)29-25(33)28-19-8-6-7-18(16-19)27-24(31)21-9-4-5-10-22(21)26/h4-14,16H,2-3,15H2,1H3,(H,27,31)(H2,28,29,30,33)

Composition: C (62.30%), H (5.02%), Cl (7.35%), N (8.72%), O (9.96%), S (6.65%)

Molar Mass: 482

Atom Count: 57

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	481.1226905
Formal Charge	0
FSP3	0.16
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	XGHRXWNSPHQNII-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	138.5
Topological Polar Surface Area	79.46
Polarizability	51.7
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H24ClN3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00