3-[(Z)-{[(4-tert-butylphenyl)formamido]imino}methyl]phenyl thiophene-2-carboxylate

3-[(Z)-{[(4-tert-butylphenyl)formamido]imino}methyl]phenyl thiophene-2-carboxylate

Formula: C23H22N2O3S

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NN=C/C1=CC=CC(OC(=O)C2=CC=CS2)=C1

IUPAC: 3-[(Z)-{[(4-tert-butylphenyl)formamido]imino}methyl]phenyl thiophene-2-carboxylate

InChI: InChI=1S/C23H22N2O3S/c1-23(2,3)18-11-9-17(10-12-18)21(26)25-24-15-16-6-4-7-19(14-16)28-22(27)20-8-5-13-29-20/h4-15H,1-3H3,(H,25,26)/b24-15-

Composition: C (67.96%), H (5.46%), N (6.89%), O (11.81%), S (7.89%)

Molar Mass: 406.5

Atom Count: 51

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	406.13511375
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WCWYJOIGUUXNKQ-IWIPYMOSSA-N
Lipinski's Rule of Five
Molar Refractivity	115.59
Topological Polar Surface Area	67.76
Polarizability	43.42
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H22N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00