ethyl 2-(2-{[4-(3,4-dihydroxyphenyl)-1,3-thiazol-2-yl]sulfanyl}acetamido)acetate

ethyl 2-(2-{[4-(3,4-dihydroxyphenyl)-1,3-thiazol-2-yl]sulfanyl}acetamido)acetate

Formula: C15H16N2O5S2

SMILES: CCOC(=O)CNC(=O)CSC1=NC(=CS1)C1=CC=C(O)C(O)=C1

IUPAC: ethyl 2-(2-{[4-(3,4-dihydroxyphenyl)-1,3-thiazol-2-yl]sulfanyl}acetamido)acetate

InChI: InChI=1S/C15H16N2O5S2/c1-2-22-14(21)6-16-13(20)8-24-15-17-10(7-23-15)9-3-4-11(18)12(19)5-9/h3-5,7,18-19H,2,6,8H2,1H3,(H,16,20)

Composition: C (48.90%), H (4.38%), N (7.60%), O (21.71%), S (17.40%)

Molar Mass: 368.42

Atom Count: 40

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	368.050063971
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	KWVCTKVTQKGHKW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.78
Topological Polar Surface Area	108.75
Polarizability	36.43
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H16N2O5S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00