P664-0129 Screening compound: (6-methoxy-3-pyridyl)[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazino]methanone
Chemical Structure Depiction of ChemDiv screening compound P664-0129
(6-methoxy-3-pyridyl)[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazino]methanone
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
P664-0129
Molecular Formula
C17H19N7O2 (C17 H19 N7 O2)
Compound Name
(6-methoxy-3-pyridyl)[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazino]methanone
IUPAC name
1-(6-methoxypyridine-3-carbonyl)-4-{5-methyl-[124]triazolo[43-a]pyrimidin-7-yl}piperazine
SMILES
Cc1cc(N(CC2)CCN2C(c(cc2)cnc2OC)=O)nc2nncn12
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
353.38
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
0.856
Distribution Coefficient, logD
0.856
Water Solubility, LogSw
-1.46
Polar Surface Area
68.096
Acid Dissociation Constant (pKa)
23.26
Base Dissociation Constant (pKb)
4.04
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
35.29
P664-0129 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Akt-Targeted Library (14764 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Proteases
- Kinases
References: we are preparing a list of scientific research reports with P664-0129 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)