V015-7935 Screening compound: 1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-one

V015-7935 Screening compound: 1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-one
V015-7935 Screening compound: 1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-7935
1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-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

V015-7935

Molecular Formula

C29H34N6OS (C29 H34 N6 OS)

Compound Name

1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-one

IUPAC name

1-(4-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[34-d]pyrimidin-4-yl}-14-diazepan-1-yl)-2-(phenylsulfanyl)ethan-1-one

SMILES

CCCCc1nc(n(-c2ccccc2)nc2C)c2c(N(CCC2)CCN2C(CSc2ccccc2)=O)n1

InChI

InChI=1S/C29H34N6OS/c1-3-4-16-25-30-28(27-22(2)32-35(29(27)31-25)23-12-7-5-8-13-23)34-18-11-17-33(19-20-34)26(36)21-37-24-14-9-6-10-15-24/h5-10,12-15H,3-4,11,16-21H2,1-2H3

InChI Key

GCOCPAFONAHVEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857229

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

514.69

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.686

Distribution Coefficient, logD

5.140

Water Solubility, LogSw

-5.58

Polar Surface Area

54.225

Acid Dissociation Constant (pKa)

21.73

Base Dissociation Constant (pKb)

7.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

References: we are preparing a list of scientific research reports with V015-7935 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-7935?
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What is the minimum amount of V015-7935 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-7935
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-7935
  • 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 V015-7935 available by request