N-(3,4-dimethylphenyl)-2-[(5E)-2,4-dioxo-5-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1,3-thiazolidin-3-yl]acetamide

N-(3,4-dimethylphenyl)-2-[(5E)-2,4-dioxo-5-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1,3-thiazolidin-3-yl]acetamide

Formula: C23H22N2O4S

SMILES: CC1=CC=C(NC(=O)CN2C(=O)SC(=CC3=CC=C(OCC=C)C=C3)C2=O)C=C1C

IUPAC: N-(3,4-dimethylphenyl)-2-[(5E)-2,4-dioxo-5-{[4-(prop-2-en-1-yloxy)phenyl]methylidene}-1,3-thiazolidin-3-yl]acetamide

InChI: InChI=1S/C23H22N2O4S/c1-4-11-29-19-9-6-17(7-10-19)13-20-22(27)25(23(28)30-20)14-21(26)24-18-8-5-15(2)16(3)12-18/h4-10,12-13H,1,11,14H2,2-3H3,(H,24,26)/b20-13+

Composition: C (65.39%), H (5.25%), N (6.63%), O (15.15%), S (7.59%)

Molar Mass: 422.5

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	422.13002837
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GHNFWUQDHUVTKB-DEDYPNTBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	121.19
Topological Polar Surface Area	75.71
Polarizability	45.08
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H22N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00