V019-9725 Screening compound: 1-ethyl-3-(4-methylphenyl)-7-[(3-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V019-9725 Screening compound: 1-ethyl-3-(4-methylphenyl)-7-[(3-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V019-9725 Screening compound: 1-ethyl-3-(4-methylphenyl)-7-[(3-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-9725
1-ethyl-3-(4-methylphenyl)-7-[(3-methylphenyl)methyl]-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

V019-9725

Molecular Formula

C22H22N4O2 (C22 H22 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

CCN(C(c1c(N2c3ccc(C)cc3)ncn1Cc1cc(C)ccc1)=O)C2=O

InChI

InChI=1S/C22H22N4O2/c1-4-25-21(27)19-20(26(22(25)28)18-10-8-15(2)9-11-18)23-14-24(19)13-17-7-5-6-16(3)12-17/h5-12,14H,4,13H2,1-3H3

InChI Key

CLYLUZZWJVOXFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19904787

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

374.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.750

Distribution Coefficient, logD

3.750

Water Solubility, LogSw

-3.78

Polar Surface Area

42.271

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with V019-9725 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-9725?
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What is the minimum amount of V019-9725 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-9725
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-9725
  • 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 V019-9725 available by request