ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-2-[2-(4-methoxyphenyl)acetamido]-4-methylthiophene-3-carboxylate

ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-2-[2-(4-methoxyphenyl)acetamido]-4-methylthiophene-3-carboxylate

Formula: C25H25ClN2O5S

SMILES: CCOC(=O)C1=C(NC(=O)CC2=CC=C(OC)C=C2)SC(C(=O)NC2=CC=CC(Cl)=C2C)=C1C

IUPAC: ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-2-[2-(4-methoxyphenyl)acetamido]-4-methylthiophene-3-carboxylate

InChI: InChI=1S/C25H25ClN2O5S/c1-5-33-25(31)21-15(3)22(23(30)27-19-8-6-7-18(26)14(19)2)34-24(21)28-20(29)13-16-9-11-17(32-4)12-10-16/h6-12H,5,13H2,1-4H3,(H,27,30)(H,28,29)

Composition: C (59.94%), H (5.03%), Cl (7.08%), N (5.59%), O (15.97%), S (6.40%)

Molar Mass: 500.99

Atom Count: 59

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	500.1172708
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	XNOSLQLGXNOLPJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	135.35
Topological Polar Surface Area	93.73
Polarizability	50.34
Ring Count	3
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H25ClN2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00