ethyl 2-amino-4-methyl-5-[(4-methylphenyl)carbamoyl]thiophene-3-carboxylate

ethyl 2-amino-4-methyl-5-[(4-methylphenyl)carbamoyl]thiophene-3-carboxylate

Formula: C16H18N2O3S

SMILES: CCOC(=O)C1=C(N)SC(C(=O)NC2=CC=C(C)C=C2)=C1C

IUPAC: ethyl 2-amino-4-methyl-5-[(4-methylphenyl)carbamoyl]thiophene-3-carboxylate

InChI: InChI=1S/C16H18N2O3S/c1-4-21-16(20)12-10(3)13(22-14(12)17)15(19)18-11-7-5-9(2)6-8-11/h5-8H,4,17H2,1-3H3,(H,18,19)

Composition: C (60.36%), H (5.70%), N (8.80%), O (15.07%), S (10.07%)

Molar Mass: 318.39

Atom Count: 40

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	318.103813622
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	NCFGDIOCFOGBDV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.2
Topological Polar Surface Area	81.42
Polarizability	32.57
Ring Count	2
Rotatable Bond Count	5

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<2 Days	C16H18N2O3S		$101.60$101.60

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H18N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00