ethyl 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamido]benzoate

ethyl 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamido]benzoate

Formula: C14H16N2O3S2

SMILES: CCOC(=O)C1=CC=C(NC(=O)CSC2=NCCS2)C=C1

IUPAC: ethyl 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamido]benzoate

InChI: InChI=1S/C14H16N2O3S2/c1-2-19-13(18)10-3-5-11(6-4-10)16-12(17)9-21-14-15-7-8-20-14/h3-6H,2,7-9H2,1H3,(H,16,17)

Composition: C (51.83%), H (4.97%), N (8.64%), O (14.80%), S (19.76%)

Molar Mass: 324.41

Atom Count: 37

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	324.060234731
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CEPZOGQJINUYRY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.1
Topological Polar Surface Area	67.76
Polarizability	33.2
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H16N2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00