ethyl 4-{2-[1-(4-chlorophenyl)-3-(3-methoxybenzamido)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate

ethyl 4-{2-[1-(4-chlorophenyl)-3-(3-methoxybenzamido)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate

Formula: C28H25ClN4O6S

SMILES: CCOC(=O)C1=CC=C(NC(=O)CC2N(NC(=O)C3=CC=CC(OC)=C3)C(=S)N(C2=O)C2=CC=C(Cl)C=C2)C=C1

IUPAC: ethyl 4-{2-[1-(4-chlorophenyl)-3-(3-methoxybenzamido)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetamido}benzoate

InChI: InChI=1/C28H25ClN4O6S/c1-3-39-27(37)17-7-11-20(12-8-17)30-24(34)16-23-26(36)32(21-13-9-19(29)10-14-21)28(40)33(23)31-25(35)18-5-4-6-22(15-18)38-2/h4-15,23H,3,16H2,1-2H3,(H,30,34)(H,31,35)

Composition: C (57.88%), H (4.34%), Cl (6.10%), N (9.64%), O (16.52%), S (5.52%)

Molar Mass: 581.04

Atom Count: 65

Heavy Atom Count: 40

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	580.1183334
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	GNNYOJHJLVBRHE-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	154.1
Topological Polar Surface Area	117.28
Polarizability	58.5
Ring Count	4
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H25ClN4O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00