ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(3-phenylpropanamido)thiophene-3-carboxylate

ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(3-phenylpropanamido)thiophene-3-carboxylate

Formula: C25H26N2O5S

SMILES: CCOC(=O)C1=C(NC(=O)CCC2=CC=CC=C2)SC(C(=O)NC2=CC=C(OC)C=C2)=C1C

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

InChI: InChI=1S/C25H26N2O5S/c1-4-32-25(30)21-16(2)22(23(29)26-18-11-13-19(31-3)14-12-18)33-24(21)27-20(28)15-10-17-8-6-5-7-9-17/h5-9,11-14H,4,10,15H2,1-3H3,(H,26,29)(H,27,28)

Composition: C (64.36%), H (5.62%), N (6.00%), O (17.15%), S (6.87%)

Molar Mass: 466.55

Atom Count: 59

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	466.156243119
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	UALXZSDWARSIGL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	130.11
Topological Polar Surface Area	93.73
Polarizability	48.51
Ring Count	3
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H26N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00