methyl 2-[(5Z)-5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-3-methyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]acetate

methyl 2-[(5Z)-5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-3-methyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]acetate

Formula: C22H22N2O5S

SMILES: COC(=O)CN1C(=S)N(C)C(=O)C1=CC1=CC=C(OCC2=CC=CC=C2)C(OC)=C1

IUPAC: methyl 2-[(5Z)-5-{[4-(benzyloxy)-3-methoxyphenyl]methylidene}-3-methyl-4-oxo-2-sulfanylideneimidazolidin-1-yl]acetate

InChI: InChI=1S/C22H22N2O5S/c1-23-21(26)17(24(22(23)30)13-20(25)28-3)11-16-9-10-18(19(12-16)27-2)29-14-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3/b17-11-

Composition: C (61.96%), H (5.20%), N (6.57%), O (18.76%), S (7.52%)

Molar Mass: 426.49

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	426.12494299
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	LPDHMLHLBNBTRV-BOPFTXTBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	117.9
Topological Polar Surface Area	68.31
Polarizability	45.27
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00