4-cyano-N,N-diethyl-3-methyl-5-(3,4,5-triethoxybenzamido)thiophene-2-carboxamide

4-cyano-N,N-diethyl-3-methyl-5-(3,4,5-triethoxybenzamido)thiophene-2-carboxamide

Formula: C24H31N3O5S

SMILES: CCOC1=CC(=CC(OCC)=C1OCC)C(=O)NC1=C(C#N)C(C)=C(S1)C(=O)N(CC)CC

IUPAC: 4-cyano-N,N-diethyl-3-methyl-5-(3,4,5-triethoxybenzamido)thiophene-2-carboxamide

InChI: InChI=1S/C24H31N3O5S/c1-7-27(8-2)24(29)21-15(6)17(14-25)23(33-21)26-22(28)16-12-18(30-9-3)20(32-11-5)19(13-16)31-10-4/h12-13H,7-11H2,1-6H3,(H,26,28)

Composition: C (60.87%), H (6.60%), N (8.87%), O (16.89%), S (6.77%)

Molar Mass: 473.59

Atom Count: 64

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	473.198442284
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	XOZKBEJQYFPECT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	130.41
Topological Polar Surface Area	100.89
Polarizability	48.55
Ring Count	2
Rotatable Bond Count	11

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H31N3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00