Text Search
Structure Search

N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

Formula: C16H16ClN5O2

SMILES: COC1=CC(CNC2=NNN=N2)=CC=C1OCC1=CC=CC(Cl)=C1

IUPAC: N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

InChI: InChI=1S/C16H16ClN5O2/c1-23-15-8-11(9-18-16-19-21-22-20-16)5-6-14(15)24-10-12-3-2-4-13(17)7-12/h2-8H,9-10H2,1H3,(H2,18,19,20,21,22)

Composition: C (55.58%), H (4.66%), Cl (10.25%), N (20.25%), O (9.25%)

Molar Mass: 345.79

Atom Count: 40

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 345.0992525
Formal Charge 0
FSP3 0.19
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey PEMVLEOZEFVSRS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 95.11
Topological Polar Surface Area 84.95
Polarizability 34.48
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H16ClN5O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote