1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]carbamoyl}propyl 2-methylquinoline-4-carboxylate

1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]carbamoyl}propyl 2-methylquinoline-4-carboxylate

Formula: C22H23N3O5S

SMILES: CCOC(=O)C1=C(C)N=C(NC(=O)C(CC)OC(=O)C2=CC(C)=NC3=CC=CC=C23)S1

IUPAC: 1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]carbamoyl}propyl 2-methylquinoline-4-carboxylate

InChI: InChI=1/C22H23N3O5S/c1-5-17(19(26)25-22-24-13(4)18(31-22)21(28)29-6-2)30-20(27)15-11-12(3)23-16-10-8-7-9-14(15)16/h7-11,17H,5-6H2,1-4H3,(H,24,25,26)

Composition: C (59.85%), H (5.25%), N (9.52%), O (18.12%), S (7.26%)

Molar Mass: 441.5

Atom Count: 54

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	441.135842027
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	FCESTCPFOKCXSE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.81
Topological Polar Surface Area	107.48
Polarizability	45.31
Ring Count	3
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H23N3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00