V022-7234 Screening compound: 7-benzyl-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

V022-7234 Screening compound: 7-benzyl-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
V022-7234 Screening compound: 7-benzyl-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-7234
7-benzyl-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

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

V022-7234

Molecular Formula

C29H34N4O3S (C29 H34 N4 O3 S)

Compound Name

7-benzyl-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

IUPAC name

11-benzyl-5-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}-8-thia-4611-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)5-trien-3-one

SMILES

COCCCN(CC(c1ccccc1)O)CC(N1)=Nc(sc2c3CCN(Cc4ccccc4)C2)c3C1=O

InChI

InChI=1S/C29H34N4O3S/c1-36-16-8-14-32(18-24(34)22-11-6-3-7-12-22)20-26-30-28(35)27-23-13-15-33(17-21-9-4-2-5-10-21)19-25(23)37-29(27)31-26/h2-7,9-12,24,34H,8,13-20H2,1H3,(H,30,31,35)/t24-/m0/s1

InChI Key

HDZRPCBVGWIDMK-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19870691

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

518.68

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.317

Distribution Coefficient, logD

3.312

Water Solubility, LogSw

-3.67

Polar Surface Area

66.653

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

4.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.90

V022-7234 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V022-7234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-7234?
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What is the minimum amount of V022-7234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-7234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-7234
  • 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 V022-7234 available by request