L982-0206 Screening compound: 2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide

L982-0206 Screening compound: 2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
L982-0206 Screening compound: 2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L982-0206
2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide

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

L982-0206

Molecular Formula

C24H21F2N5O3 (C24 H21 F2 N5 O3)

Compound Name

2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide

IUPAC name

2-{[(3-fluorophenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-68-dimethyl-1-oxo-1H2H-pyrrolo[12-d][124]triazine-7-carboxamide

SMILES

Cc1c(C(N(CC(Nc2cccc(F)c2)=O)N=C2)=O)n2c(C)c1C(NCc(cc1)ccc1F)=O

InChI

InChI=1S/C24H21F2N5O3/c1-14-21(23(33)27-11-16-6-8-17(25)9-7-16)15(2)30-13-28-31(24(34)22(14)30)12-20(32)29-19-5-3-4-18(26)10-19/h3-10,13H,11-12H2,1-2H3,(H,27,33)(H,29,32)

InChI Key

RWLZHSCCYDXKLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27491136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.401

Distribution Coefficient, logD

2.396

Water Solubility, LogSw

-2.91

Polar Surface Area

77.519

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

L982-0206 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L982-0206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L982-0206?
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What is the minimum amount of L982-0206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L982-0206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L982-0206
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L982-0206 available by request