G866-1169 Screening compound: ethyl 4-(4-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazin-1-yl)-4-oxobutanoate
Chemical Structure Depiction of ChemDiv screening compound G866-1169
ethyl 4-(4-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazin-1-yl)-4-oxobutanoate
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
G866-1169
Molecular Formula
C21H25N7O3 (C21 H25 N7 O3)
Compound Name
ethyl 4-(4-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}piperazin-1-yl)-4-oxobutanoate
IUPAC name
ethyl 4-(4-{3-benzyl-3H-[123]triazolo[45-d]pyrimidin-7-yl}piperazin-1-yl)-4-oxobutanoate
SMILES
CCOC(CCC(N(CC1)CCN1c1ncnc2c1nnn2Cc1ccccc1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
423.47
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
1.527
Distribution Coefficient, logD
1.527
Water Solubility, LogSw
-1.78
Polar Surface Area
86.848
Acid Dissociation Constant (pKa)
19.60
Base Dissociation Constant (pKb)
3.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.90
G866-1169 in Drug Discovery
Included in Screening Libraries
C-Met Library (15277 compounds)
Nucleoside Mimetics Library (2197 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Purine Based Nucleoside Mimetics Library (1131 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Antiviral
- Infections
- Cancer
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Kinases
- Kinases
- Receptor's ligands
- Mimetics
References: we are preparing a list of scientific research reports with G866-1169 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)