1-[(E)-({4-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl}methylidene)amino]-3-methylthiourea

1-[(E)-({4-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl}methylidene)amino]-3-methylthiourea

Formula: C23H31N3O3S

SMILES: CNC(=S)NN=CC1=CC=C(OCCCOC2=CC=C(C=C2)C(C)(C)C)C(OC)=C1

IUPAC: 1-[(E)-({4-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl}methylidene)amino]-3-methylthiourea

InChI: InChI=1S/C23H31N3O3S/c1-23(2,3)18-8-10-19(11-9-18)28-13-6-14-29-20-12-7-17(15-21(20)27-5)16-25-26-22(30)24-4/h7-12,15-16H,6,13-14H2,1-5H3,(H2,24,26,30)/b25-16+

Composition: C (64.31%), H (7.27%), N (9.78%), O (11.17%), S (7.46%)

Molar Mass: 429.58

Atom Count: 61

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	429.208613044
Formal Charge	0
FSP3	0.39
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	BZUAXUCGWYZHPU-PCLIKHOPSA-N
Lipinski's Rule of Five	1
Molar Refractivity	126.14
Topological Polar Surface Area	64.11
Polarizability	48.56
Ring Count	2
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H31N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00