V031-1750 Screening compound: 3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V031-1750 Screening compound: 3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V031-1750 Screening compound: 3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1750
3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-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

V031-1750

Molecular Formula

C24H22Cl2N4O3 (C24 H22 Cl2 N4 O3)

Compound Name

3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-(4-chlorophenyl)-7-[2-(4-chlorophenyl)-2-oxoethyl]-1-(3-methylbutyl)-2367-tetrahydro-1H-purine-26-dione

SMILES

CC(C)CCN(C(c1c(N2c(cc3)ccc3Cl)ncn1CC(c(cc1)ccc1Cl)=O)=O)C2=O

InChI

InChI=1S/C24H22Cl2N4O3/c1-15(2)11-12-29-23(32)21-22(30(24(29)33)19-9-7-18(26)8-10-19)27-14-28(21)13-20(31)16-3-5-17(25)6-4-16/h3-10,14-15H,11-13H2,1-2H3

InChI Key

WPJPKVZWYUPNFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19920585

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.674

Distribution Coefficient, logD

4.674

Water Solubility, LogSw

-4.77

Polar Surface Area

55.771

Acid Dissociation Constant (pKa)

14.64

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V031-1750 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1750?
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What is the minimum amount of V031-1750 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1750
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1750
  • 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 V031-1750 available by request