V019-8388 Screening compound: 1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

V019-8388 Screening compound: 1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane
V019-8388 Screening compound: 1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-8388
1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

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

V019-8388

Molecular Formula

C29H32F2N6O (C29 H32 F2 N6 O)

Compound Name

1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

IUPAC name

1-(3-fluorobenzoyl)-4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[34-d]pyrimidin-4-yl]-14-diazepane

SMILES

CCCC(C)c1nc(n(-c(cc2)ccc2F)nc2C)c2c(N(CCC2)CCN2C(c2cccc(F)c2)=O)n1

InChI

InChI=1S/C29H32F2N6O/c1-4-7-19(2)26-32-27(25-20(3)34-37(28(25)33-26)24-12-10-22(30)11-13-24)35-14-6-15-36(17-16-35)29(38)21-8-5-9-23(31)18-21/h5,8-13,18-19H,4,6-7,14-17H2,1-3H3/t19-/m0/s1

InChI Key

MJMGXQBWIYMSMI-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19862546

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

518.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.824

Distribution Coefficient, logD

5.203

Water Solubility, LogSw

-5.79

Polar Surface Area

53.762

Acid Dissociation Constant (pKa)

21.58

Base Dissociation Constant (pKb)

7.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.90

References: we are preparing a list of scientific research reports with V019-8388 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-8388?
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What is the minimum amount of V019-8388 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-8388
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-8388
  • 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 V019-8388 available by request