3-[(4-butoxy-3-chlorophenyl)methyl]-1-[(Z)-[(4-hydroxyphenyl)methylidene]amino]thiourea

3-[(4-butoxy-3-chlorophenyl)methyl]-1-[(Z)-[(4-hydroxyphenyl)methylidene]amino]thiourea

Formula: C19H22ClN3O2S

SMILES: CCCCOC1=CC=C(CNC(=S)NN=C/C2=CC=C(O)C=C2)C=C1Cl

IUPAC: 3-[(4-butoxy-3-chlorophenyl)methyl]-1-[(Z)-[(4-hydroxyphenyl)methylidene]amino]thiourea

InChI: InChI=1S/C19H22ClN3O2S/c1-2-3-10-25-18-9-6-15(11-17(18)20)12-21-19(26)23-22-13-14-4-7-16(24)8-5-14/h4-9,11,13,24H,2-3,10,12H2,1H3,(H2,21,23,26)/b22-13-

Composition: C (58.23%), H (5.66%), Cl (9.05%), N (10.72%), O (8.16%), S (8.18%)

Molar Mass: 391.91

Atom Count: 48

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	391.1121258
Formal Charge	0
FSP3	0.26
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	ZWOOYDVEBBDNTO-XKZIYDEJSA-N
Lipinski's Rule of Five
Molar Refractivity	110.86
Topological Polar Surface Area	65.88
Polarizability	42.4
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H22ClN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00