V009-2126 Screening compound: N-[2,6-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide

V009-2126 Screening compound: N-[2,6-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide
V009-2126 Screening compound: N-[2,6-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-2126
N-[2,6-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide

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

V009-2126

Molecular Formula

C33H43N7O (C33 H43 N7 O)

Compound Name

N-[2,6-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepane-1-carboxamide

IUPAC name

N-[26-bis(propan-2-yl)phenyl]-4-{3-methyl-1-phenyl-6-propyl-1H-pyrazolo[34-d]pyrimidin-4-yl}-14-diazepane-1-carboxamide

SMILES

CCCc1nc(n(-c2ccccc2)nc2C)c2c(N(CCC2)CCN2C(Nc2c(C(C)C)cccc2C(C)C)=O)n1

InChI

InChI=1S/C33H43N7O/c1-7-13-28-34-31(29-24(6)37-40(32(29)35-28)25-14-9-8-10-15-25)38-18-12-19-39(21-20-38)33(41)36-30-26(22(2)3)16-11-17-27(30)23(4)5/h8-11,14-17,22-23H,7,12-13,18-21H2,1-6H3,(H,36,41)

InChI Key

AMLQLIMWFQSCRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19853842

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

553.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.156

Distribution Coefficient, logD

5.712

Water Solubility, LogSw

-5.74

Polar Surface Area

62.178

Acid Dissociation Constant (pKa)

15.34

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.46

References: we are preparing a list of scientific research reports with V009-2126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-2126?
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What is the minimum amount of V009-2126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-2126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-2126
  • 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 V009-2126 available by request