D150-0109 Screening compound: 5-[4-(3-chlorophenyl)piperazino]-7,8-dihydro-6H-cyclopenta[d][1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of ChemDiv screening compound D150-0109
5-[4-(3-chlorophenyl)piperazino]-7,8-dihydro-6H-cyclopenta[d][1,2,4]triazolo[4,3-a]pyrimidine
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
D150-0109
Molecular Formula
C18H19ClN6 (C18 H19 ClN6)
Compound Name
5-[4-(3-chlorophenyl)piperazino]-7,8-dihydro-6H-cyclopenta[d][1,2,4]triazolo[4,3-a]pyrimidine
IUPAC name
2-[4-(3-chlorophenyl)piperazin-1-yl]-181011-tetraazatricyclo[7.3.0.0^{37}]dodeca-27911-tetraene
SMILES
Clc1cc(N(CC2)CCN2c2c(CCC3)c3nc3nncn23)ccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
354.84
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.798
Distribution Coefficient, logD
2.798
Water Solubility, LogSw
-3.27
Polar Surface Area
43.516
Acid Dissociation Constant (pKa)
20.27
Base Dissociation Constant (pKb)
2.60
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
38.90
D150-0109 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
3D-Pharmacophore Based Diversity Library (49813 compounds)
GPCR Targeted Library (31838 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with D150-0109 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)