V022-8277 Screening compound: 2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine

V022-8277 Screening compound: 2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine
V022-8277 Screening compound: 2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-8277
2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-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

V022-8277

Molecular Formula

C20H19F3N2O (C20 H19 F3 N2 O)

Compound Name

2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepine

IUPAC name

2-[(furan-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]-1H2H3H4H5H-pyrrolo[12-a][14]diazepine

SMILES

FC(c1ccc(C2N(Cc3cocc3)CCCn3c2ccc3)cc1)(F)F

InChI

InChI=1S/C20H19F3N2O/c21-20(22,23)17-6-4-16(5-7-17)19-18-3-1-9-24(18)10-2-11-25(19)13-15-8-12-26-14-15/h1,3-9,12,14,19H,2,10-11,13H2/t19-/m1/s1

InChI Key

PVHSEEZDXHJGJH-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19892864

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

360.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.482

Distribution Coefficient, logD

3.492

Water Solubility, LogSw

-4.40

Polar Surface Area

13.745

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

V022-8277 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V022-8277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-8277?
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What is the minimum amount of V022-8277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-8277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-8277
  • 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 V022-8277 available by request