Text Search
Structure Search

1-(4-chlorophenyl)-4-{1H-pyrrolo[2,3-b]pyridin-3-ylmethyl}piperazine

1-(4-chlorophenyl)-4-{1H-pyrrolo[2,3-b]pyridin-3-ylmethyl}piperazine

CAS: 158985-00-3

Formula: C18H19ClN4

SMILES: ClC1=CC=C(C=C1)N1CCN(CC2=CNC3=NC=CC=C23)CC1

IUPAC: 1-(4-chlorophenyl)-4-({1H-pyrrolo[2,3-b]pyridin-3-yl}methyl)piperazine

InChI: InChI=1S/C18H19ClN4/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18/h1-7,12H,8-11,13H2,(H,20,21)

Composition: C (66.15%), H (5.86%), Cl (10.85%), N (17.14%)

Molar Mass: 326.83

Atom Count: 42

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 326.1298243
Formal Charge 0
FSP3 0.28
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey OGJGQVFWEPNYSB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.84
Topological Polar Surface Area 35.16
Polarizability 36.57
Ring Count 4
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <10 Days 158985-00-3 Quote Only
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
99% <7 Days 158985-00-3 $218.39-$310.50$218.39$310.50
Request Quote
AA BLOCKS INC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
99% <6 Days 158985-00-3 $146.05-$219.65$146.05$219.65
Request Quote