P664-1279 Screening compound: 1-cyclopropanecarbonyl-4-[5-(propan-2-yl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazine
Chemical Structure Depiction of ChemDiv screening compound P664-1279
1-cyclopropanecarbonyl-4-[5-(propan-2-yl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazine
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
P664-1279
Molecular Formula
C16H22N6O (C16 H22 N6 O)
Compound Name
1-cyclopropanecarbonyl-4-[5-(propan-2-yl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazine
IUPAC name
1-cyclopropanecarbonyl-4-[5-(propan-2-yl)-[124]triazolo[43-a]pyrimidin-7-yl]piperazine
SMILES
CC(C)c1cc(N(CC2)CCN2C(C2CC2)=O)nc2nncn12
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
314.39
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.817
Distribution Coefficient, logD
1.817
Water Solubility, LogSw
-1.84
Polar Surface Area
51.067
Acid Dissociation Constant (pKa)
22.91
Base Dissociation Constant (pKb)
1.34
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
62.50
P664-1279 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Soluble Diversity Library (15920 compounds)
Included in 1.7M Stock Database
- Nervous system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Proteases
References: we are preparing a list of scientific research reports with P664-1279 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)