V011-3222 Screening compound: N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide

V011-3222 Screening compound: N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide
V011-3222 Screening compound: N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3222
N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-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

V011-3222

Molecular Formula

C28H32FN7O (C28 H32 FN7 O)

Compound Name

N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane-1-carboxamide

IUPAC name

N-ethyl-4-[1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[34-d]pyrimidin-4-yl]-14-diazepane-1-carboxamide

SMILES

CCNC(N(CCC1)CCN1c1c(c(C)nn2-c(cc3)ccc3F)c2nc(Cc2ccc(C)cc2)n1)=O

InChI

InChI=1S/C28H32FN7O/c1-4-30-28(37)35-15-5-14-34(16-17-35)26-25-20(3)33-36(23-12-10-22(29)11-13-23)27(25)32-24(31-26)18-21-8-6-19(2)7-9-21/h6-13H,4-5,14-18H2,1-3H3,(H,30,37)

InChI Key

UISYSSNQFBBQOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19862948

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.866

Distribution Coefficient, logD

4.764

Water Solubility, LogSw

-4.79

Polar Surface Area

64.521

Acid Dissociation Constant (pKa)

16.62

Base Dissociation Constant (pKb)

6.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V011-3222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3222?
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What is the minimum amount of V011-3222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3222
  • 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 V011-3222 available by request