V025-5467 Screening compound: 3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

V025-5467 Screening compound: 3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide
V025-5467 Screening compound: 3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-5467
3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

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

V025-5467

Molecular Formula

C24H27N5O2S (C24 H27 N5 O2 S)

Compound Name

3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

IUPAC name

3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide

SMILES

CCc1nc(SCc2cc(C(NCc3cnccc3)=O)ccc2)nc(N2CCOCC2)c1

InChI

InChI=1S/C24H27N5O2S/c1-2-21-14-22(29-9-11-31-12-10-29)28-24(27-21)32-17-18-5-3-7-20(13-18)23(30)26-16-19-6-4-8-25-15-19/h3-8,13-15H,2,9-12,16-17H2,1H3,(H,26,30)

InChI Key

ISITVTBKZWICAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19816382

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

449.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.538

Distribution Coefficient, logD

3.538

Water Solubility, LogSw

-3.46

Polar Surface Area

62.511

Acid Dissociation Constant (pKa)

11.96

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V025-5467 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V025-5467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-5467?
Check Price and Availability of V025-5467, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V025-5467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-5467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-5467
  • 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 V025-5467 available by request