1-[(E)-[(3-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]amino]-3-methylthiourea

1-[(E)-[(3-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]amino]-3-methylthiourea

Formula: C22H27N3O4S

SMILES: CNC(=S)NN=CC1=CC=C(OCCOC2=CC=C(CC=C)C=C2OC)C(OC)=C1

IUPAC: 1-[(E)-[(3-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]amino]-3-methylthiourea

InChI: InChI=1S/C22H27N3O4S/c1-5-6-16-7-9-18(20(13-16)26-3)28-11-12-29-19-10-8-17(14-21(19)27-4)15-24-25-22(30)23-2/h5,7-10,13-15H,1,6,11-12H2,2-4H3,(H2,23,25,30)/b24-15+

Composition: C (61.52%), H (6.34%), N (9.78%), O (14.90%), S (7.46%)

Molar Mass: 429.54

Atom Count: 57

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	429.172227535
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	SEJSFYPUXCESIX-BUVRLJJBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	123.36
Topological Polar Surface Area	73.34
Polarizability	47.23
Ring Count	2
Rotatable Bond Count	11

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H27N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00