V011-8234 Screening compound: 4-(2,4-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-7-one

V011-8234 Screening compound: 4-(2,4-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-7-one
V011-8234 Screening compound: 4-(2,4-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-8234
4-(2,4-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-7-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

V011-8234

Molecular Formula

C33H32F2N4O2S (C33 H32 F2 N4 O2 S)

Compound Name

4-(2,4-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H,4H,6H,7H,8H-pyrazolo[3,4-e][1,4]thiazepin-7-one

IUPAC name

4-(24-difluorophenyl)-1-(4-methylphenyl)-8-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-phenyl-1H4H6H7H8H-pyrazolo[34-e][14]thiazepin-7-one

SMILES

CC(CC1)CCN1C(CN(c1c(C(c(ccc(F)c2)c2F)SC2)c(-c3ccccc3)nn1-c1ccc(C)cc1)C2=O)=O

InChI

InChI=1S/C33H32F2N4O2S/c1-21-8-11-25(12-9-21)39-33-30(31(36-39)23-6-4-3-5-7-23)32(26-13-10-24(34)18-27(26)35)42-20-29(41)38(33)19-28(40)37-16-14-22(2)15-17-37/h3-13,18,22,32H,14-17,19-20H2,1-2H3/t32-/m1/s1

InChI Key

AFXDOCDSJLLKBL-JGCGQSQUSA-N

MDL Number (MFCD)

MFCD19798019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

586.71

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.484

Distribution Coefficient, logD

6.484

Water Solubility, LogSw

-5.58

Polar Surface Area

46.417

Acid Dissociation Constant (pKa)

18.90

Base Dissociation Constant (pKb)

5.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.30

References: we are preparing a list of scientific research reports with V011-8234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-8234?
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What is the minimum amount of V011-8234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-8234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-8234
  • 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 V011-8234 available by request