V021-6699 Screening compound: 3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V021-6699 Screening compound: 3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V021-6699 Screening compound: 3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6699
3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

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

V021-6699

Molecular Formula

C24H26N4O2 (C24 H26 N4 O2)

Compound Name

3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-(4-methylphenyl)-7-[(2-methylphenyl)methyl]-1-(2-methylpropyl)-2367-tetrahydro-1H-purine-26-dione

SMILES

CC(C)CN(C(c1c(N2c3ccc(C)cc3)ncn1Cc1c(C)cccc1)=O)C2=O

InChI

InChI=1S/C24H26N4O2/c1-16(2)13-27-23(29)21-22(28(24(27)30)20-11-9-17(3)10-12-20)25-15-26(21)14-19-8-6-5-7-18(19)4/h5-12,15-16H,13-14H2,1-4H3

InChI Key

BBEYJGLNGBVUNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19904839

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.797

Distribution Coefficient, logD

4.797

Water Solubility, LogSw

-4.47

Polar Surface Area

42.546

Acid Dissociation Constant (pKa)

21.78

Base Dissociation Constant (pKb)

0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with V021-6699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6699?
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What is the minimum amount of V021-6699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6699
  • 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 V021-6699 available by request