N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methoxy-8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaen-5-amine

N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methoxy-8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaen-5-amine

Formula: C21H17NO4

SMILES: COC1=CC2=C(OC3=C2C=CC=C3)C=C1NCC1=CC=C2OCOC2=C1

IUPAC: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methoxy-8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaen-5-amine

InChI: InChI=1S/C21H17NO4/c1-23-20-9-15-14-4-2-3-5-17(14)26-19(15)10-16(20)22-11-13-6-7-18-21(8-13)25-12-24-18/h2-10,22H,11-12H2,1H3

Composition: C (72.61%), H (4.93%), N (4.03%), O (18.42%)

Molar Mass: 347.37

Atom Count: 43

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	347.115758031
Formal Charge	0
FSP3	0.14
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ITSBZBAAEDRNAC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.26
Topological Polar Surface Area	52.86
Polarizability	39.79
Ring Count	5
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H17NO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00