3-[(pyridin-4-ylmethyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

3-[(pyridin-4-ylmethyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Formula: C14H14N2O4

SMILES: OC(=O)C1C2OC(C=C2)C1C(=O)NCC1=CC=NC=C1

IUPAC: 3-{[(pyridin-4-yl)methyl]carbamoyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

InChI: InChI=1/C14H14N2O4/c17-13(16-7-8-3-5-15-6-4-8)11-9-1-2-10(20-9)12(11)14(18)19/h1-6,9-12H,7H2,(H,16,17)(H,18,19)

Composition: C (61.31%), H (5.15%), N (10.21%), O (23.33%)

Molar Mass: 274.276

Atom Count: 34

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	274.095356939
Formal Charge	0
FSP3	0.36
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	NJOCHFDYBDTNNY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.59
Topological Polar Surface Area	88.52
Polarizability	26.79
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H14N2O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00