L982-0220 Screening compound: 2-{[(2-ethoxyphenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide

L982-0220 Screening compound: 2-{[(2-ethoxyphenyl)carbamoyl]methyl}-N-[(4-fluorophenyl)methyl]-6,8-dimethyl-1-oxo-1H,2H-pyrrolo[1,2-d][1,2,4]triazine-7-carboxamide
L982-0220 Screening compound: 2-{[(2-ethoxyphenyl)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 L982-0220
2-{[(2-ethoxyphenyl)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

L982-0220

Molecular Formula

C26H26FN5O4 (C26 H26 FN5 O4)

Compound Name

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

SMILES

CCOc(cccc1)c1NC(CN(C1=O)N=Cn2c1c(C)c(C(NCc(cc1)ccc1F)=O)c2C)=O

InChI

InChI=1S/C26H26FN5O4/c1-4-36-21-8-6-5-7-20(21)30-22(33)14-32-26(35)24-16(2)23(17(3)31(24)15-29-32)25(34)28-13-18-9-11-19(27)12-10-18/h5-12,15H,4,13-14H2,1-3H3,(H,28,34)(H,30,33)

InChI Key

BCLMRUFPQKPUQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27491145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.422

Distribution Coefficient, logD

2.417

Water Solubility, LogSw

-2.81

Polar Surface Area

84.032

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

L982-0220 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 L982-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L982-0220?
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What is the minimum amount of L982-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L982-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L982-0220
  • 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 L982-0220 available by request