V009-3134 Screening compound: 2-[(4-fluorophenyl)methyl]-1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine

V009-3134 Screening compound: 2-[(4-fluorophenyl)methyl]-1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine
V009-3134 Screening compound: 2-[(4-fluorophenyl)methyl]-1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-3134
2-[(4-fluorophenyl)methyl]-1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine

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

V009-3134

Molecular Formula

C21H18F4N2 (C21 H18 F4 N2)

Compound Name

2-[(4-fluorophenyl)methyl]-1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine

IUPAC name

2-[(4-fluorophenyl)methyl]-1-(245-trifluorophenyl)-1H2H3H4H5H-pyrrolo[12-a][14]diazepine

SMILES

Fc1ccc(CN(CCCn2c3ccc2)C3c(c(F)c2)cc(F)c2F)cc1

InChI

InChI=1S/C21H18F4N2/c22-15-6-4-14(5-7-15)13-27-10-2-9-26-8-1-3-20(26)21(27)16-11-18(24)19(25)12-17(16)23/h1,3-8,11-12,21H,2,9-10,13H2/t21-/m1/s1

InChI Key

CJNCLHDFEPHHCX-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19893146

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

374.38

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.004

Distribution Coefficient, logD

5.003

Water Solubility, LogSw

-4.91

Polar Surface Area

5.942

Acid Dissociation Constant (pKa)

25.05

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

V009-3134 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V009-3134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-3134?
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What is the minimum amount of V009-3134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-3134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-3134
  • 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 V009-3134 available by request