ethyl 2-[2-(4-chlorophenoxy)acetamido]-5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate

ethyl 2-[2-(4-chlorophenoxy)acetamido]-5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate

Formula: C26H25ClN2O7S

SMILES: CCOC(=O)C1=C(NC(=O)COC2=CC=C(Cl)C=C2)SC(C(=O)NC2=CC=C(C=C2)C(=O)OCC)=C1C

IUPAC: ethyl 2-[2-(4-chlorophenoxy)acetamido]-5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate

InChI: InChI=1S/C26H25ClN2O7S/c1-4-34-25(32)16-6-10-18(11-7-16)28-23(31)22-15(3)21(26(33)35-5-2)24(37-22)29-20(30)14-36-19-12-8-17(27)9-13-19/h6-13H,4-5,14H2,1-3H3,(H,28,31)(H,29,30)

Composition: C (57.30%), H (4.62%), Cl (6.50%), N (5.14%), O (20.55%), S (5.88%)

Molar Mass: 545

Atom Count: 62

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	544.1071
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	NSSDHNPENGHKBV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	141.86
Topological Polar Surface Area	120.03
Polarizability	53.06
Ring Count	3
Rotatable Bond Count	12

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H25ClN2O7S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00