G702-6271 Screening compound: 8-[4-(5-chloro-2-methylphenyl)piperazino]-2-(4-methylphenyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of ChemDiv screening compound G702-6271
8-[4-(5-chloro-2-methylphenyl)piperazino]-2-(4-methylphenyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-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
G702-6271
Molecular Formula
C26H27ClN6 (C26 H27 ClN6)
Compound Name
8-[4-(5-chloro-2-methylphenyl)piperazino]-2-(4-methylphenyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine
IUPAC name
2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-11-(4-methylphenyl)-181012-tetraazatricyclo[7.3.0.0^{37}]dodeca-27911-tetraene
SMILES
Cc(cc1)ccc1-c1nn2c(N(CC3)CCN3c3c(C)ccc(Cl)c3)c(CCC3)c3nc2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
458.99
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
6.444
Distribution Coefficient, logD
6.444
Water Solubility, LogSw
-6.50
Polar Surface Area
41.743
Acid Dissociation Constant (pKa)
19.32
Base Dissociation Constant (pKb)
3.31
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
34.60
G702-6271 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with G702-6271 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)