6321-0365 Screening compound: 7-(2-chloro-6-fluorophenyl)-5-(4-fluorophenyl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Chemical Structure Depiction of ChemDiv screening compound 6321-0365
7-(2-chloro-6-fluorophenyl)-5-(4-fluorophenyl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
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
6321-0365
Molecular Formula
C17H14ClF2N5 (C17 H14 ClF2 N5)
Compound Name
7-(2-chloro-6-fluorophenyl)-5-(4-fluorophenyl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
IUPAC name
(5S7R)-7-(2-chloro-6-fluorophenyl)-5-(4-fluorophenyl)-4H5H6H7H-[124]triazolo[15-a]pyrimidin-2-amine
SMILES
Nc1nn([C@@H](C[C@H](c(cc2)ccc2F)N2)c(c(F)ccc3)c3Cl)c2n1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
361.78
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.521
Distribution Coefficient, logD
3.493
Water Solubility, LogSw
-3.99
Polar Surface Area
58.594
Acid Dissociation Constant (pKa)
14.95
Base Dissociation Constant (pKb)
6.23
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
17.60
6321-0365 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Antiviral HBV Library (10007 compounds)
Dark Chemical Matter Library (18430 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
- Cyclic compounds
- Antiviral
- Infections
- Immune system
- PPI modulators
References: we are preparing a list of scientific research reports with 6321-0365 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)