V017-7540 Screening compound: 5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one

V017-7540 Screening compound: 5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one
V017-7540 Screening compound: 5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-7540
5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-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

V017-7540

Molecular Formula

C25H33ClN4O4S (C25 H33 ClN4 O4 S)

Compound Name

5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H,4H-thieno[2,3-d]pyrimidin-4-one

IUPAC name

5-(4-chlorophenyl)-2-({[2-hydroxy-3-(propan-2-yloxy)propyl][2-(morpholin-4-yl)ethyl]amino}methyl)-3H4H-thieno[23-d]pyrimidin-4-one

SMILES

CC(C)OCC(CN(CCN1CCOCC1)CC(N1)=Nc(scc2-c(cc3)ccc3Cl)c2C1=O)O

InChI

InChI=1S/C25H33ClN4O4S/c1-17(2)34-15-20(31)13-30(8-7-29-9-11-33-12-10-29)14-22-27-24(32)23-21(16-35-25(23)28-22)18-3-5-19(26)6-4-18/h3-6,16-17,20,31H,7-15H2,1-2H3,(H,27,28,32)/t20-/m0/s1

InChI Key

RRQWZNOXHJILBG-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19873228

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

521.08

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.768

Distribution Coefficient, logD

2.753

Water Solubility, LogSw

-3.69

Polar Surface Area

74.286

Acid Dissociation Constant (pKa)

11.91

Base Dissociation Constant (pKb)

5.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

V017-7540 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V017-7540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-7540?
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What is the minimum amount of V017-7540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-7540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-7540
  • 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 V017-7540 available by request