Text Search
Structure Search

5-(4-bromophenyl)-7-(4-methoxyphenyl)-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

5-(4-bromophenyl)-7-(4-methoxyphenyl)-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

Formula: C18H15BrN4O

SMILES: COC1=CC=C(C=C1)C1CC(=NC2=NC=NN12)C1=CC=C(Br)C=C1

IUPAC: 5-(4-bromophenyl)-7-(4-methoxyphenyl)-6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

InChI: InChI=1/C18H15BrN4O/c1-24-15-8-4-13(5-9-15)17-10-16(12-2-6-14(19)7-3-12)22-18-20-11-21-23(17)18/h2-9,11,17H,10H2,1H3

Composition: C (56.41%), H (3.95%), Br (20.85%), N (14.62%), O (4.17%)

Molar Mass: 383.249

Atom Count: 39

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 382.042924
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey JCTXFBPNMOFPNM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.27
Topological Polar Surface Area 52.3
Polarizability 36.12
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15BrN4O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote