V008-8978 Screening compound: 1-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(2-phenylcyclopropanecarbonyl)-1,4-diazepane

V008-8978 Screening compound: 1-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(2-phenylcyclopropanecarbonyl)-1,4-diazepane
V008-8978 Screening compound: 1-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(2-phenylcyclopropanecarbonyl)-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-8978
1-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(2-phenylcyclopropanecarbonyl)-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

V008-8978

Molecular Formula

C32H37FN6O (C32 H37 FN6 O)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CCc1nc(N(CCC2)CCN2C(C(C2)C2c2ccccc2)=O)c(c(C)nn2-c(cc3)ccc3F)c2n1

InChI

InChI=1S/C32H37FN6O/c1-21(2)10-15-28-34-30(29-22(3)36-39(31(29)35-28)25-13-11-24(33)12-14-25)37-16-7-17-38(19-18-37)32(40)27-20-26(27)23-8-5-4-6-9-23/h4-6,8-9,11-14,21,26-27H,7,10,15-20H2,1-3H3/t26-,27?/m0/s1

InChI Key

JCLUIAIPIWYOGV-QBHOUYDASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

540.68

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.558

Distribution Coefficient, logD

5.900

Water Solubility, LogSw

-5.93

Polar Surface Area

55.004

Acid Dissociation Constant (pKa)

18.37

Base Dissociation Constant (pKb)

7.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with V008-8978 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-8978?
Check Price and Availability of V008-8978, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V008-8978 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-8978
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-8978
  • 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 V008-8978 available by request