3-benzyl-3-[(4-tert-butylphenyl)methyl]-1-phenylthiourea

3-benzyl-3-[(4-tert-butylphenyl)methyl]-1-phenylthiourea

Formula: C25H28N2S

SMILES: CC(C)(C)C1=CC=C(CN(CC2=CC=CC=C2)C(=S)NC2=CC=CC=C2)C=C1

IUPAC: 3-benzyl-3-[(4-tert-butylphenyl)methyl]-1-phenylthiourea

InChI: InChI=1S/C25H28N2S/c1-25(2,3)22-16-14-21(15-17-22)19-27(18-20-10-6-4-7-11-20)24(28)26-23-12-8-5-9-13-23/h4-17H,18-19H2,1-3H3,(H,26,28)

Composition: C (77.28%), H (7.26%), N (7.21%), S (8.25%)

Molar Mass: 388.57

Atom Count: 56

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	388.197320084
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
InChIKey	KKUWMSGAHZBIIH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	125.27
Topological Polar Surface Area	15.27
Polarizability	48.17
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H28N2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00