V024-0437 Screening compound: 1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V024-0437 Screening compound: 1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V024-0437 Screening compound: 1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-0437
1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-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

V024-0437

Molecular Formula

C27H30N4O2 (C27 H30 N4 O2)

Compound Name

1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

1-cyclopentyl-7-[(2-methylphenyl)methyl]-3-[4-(propan-2-yl)phenyl]-2367-tetrahydro-1H-purine-26-dione

SMILES

CC(C)c(cc1)ccc1N(c1c(C(N2C3CCCC3)=O)n(Cc3c(C)cccc3)cn1)C2=O

InChI

InChI=1S/C27H30N4O2/c1-18(2)20-12-14-23(15-13-20)30-25-24(26(32)31(27(30)33)22-10-6-7-11-22)29(17-28-25)16-21-9-5-4-8-19(21)3/h4-5,8-9,12-15,17-18,22H,6-7,10-11,16H2,1-3H3

InChI Key

QQWPADFBKAKKJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19920249

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

442.56

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

5.518

Distribution Coefficient, logD

5.518

Water Solubility, LogSw

-5.39

Polar Surface Area

41.862

Acid Dissociation Constant (pKa)

21.78

Base Dissociation Constant (pKb)

-0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with V024-0437 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-0437?
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What is the minimum amount of V024-0437 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-0437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-0437
  • 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 V024-0437 available by request