Y020-4802 Screening compound: 7-(3,4-difluorophenyl)-2-methylpyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Chemical Structure Depiction of ChemDiv screening compound Y020-4802
7-(3,4-difluorophenyl)-2-methylpyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
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
Y020-4802
Molecular Formula
C14H8F2N6O (C14 H8 F2 N6 O)
Compound Name
7-(3,4-difluorophenyl)-2-methylpyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
IUPAC name
11-(34-difluorophenyl)-4-methyl-2357811-hexaazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-10-one
SMILES
Cc1nn2c(C=CN(c(cc3)cc(F)c3F)C3=O)c3nnc2n1
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
314.25
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.235
Distribution Coefficient, logD
2.235
Water Solubility, LogSw
-2.59
Polar Surface Area
63.721
Acid Dissociation Constant (pKa)
33.63
Base Dissociation Constant (pKb)
1.51
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
7.10
Y020-4802 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Anticancer Library (62698 compounds)
RNA-Protein Interaction Inhibitors Library (1986 compounds)
Included in 1.7M Stock Database
- Immune system
- Cancer
References: we are preparing a list of scientific research reports with Y020-4802 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)