E727-0631 Screening compound: [4-(4-methoxyphenyl)piperazino][2-(methylsulfanyl)-4-phenyl-5-pyrimidinyl]methanone

E727-0631 Screening compound: [4-(4-methoxyphenyl)piperazino][2-(methylsulfanyl)-4-phenyl-5-pyrimidinyl]methanone
E727-0631 Screening compound: [4-(4-methoxyphenyl)piperazino][2-(methylsulfanyl)-4-phenyl-5-pyrimidinyl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound E727-0631
[4-(4-methoxyphenyl)piperazino][2-(methylsulfanyl)-4-phenyl-5-pyrimidinyl]methanone

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

E727-0631

Molecular Formula

C23H24N4O2S (C23 H24 N4 O2 S)

Compound Name

[4-(4-methoxyphenyl)piperazino][2-(methylsulfanyl)-4-phenyl-5-pyrimidinyl]methanone

IUPAC name

n/a

SMILES

COc(cc1)ccc1N(CC1)CCN1C(c(cn1)c(-c2ccccc2)nc1SC)=O

InChI

InChI=1S/C23H24N4O2S/c1-29-19-10-8-18(9-11-19)26-12-14-27(15-13-26)22(28)20-16-24-23(30-2)25-21(20)17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3

InChI Key

CKNPZRZYKBUJJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.860

Distribution Coefficient, logD

3.860

Water Solubility, LogSw

-3.89

Polar Surface Area

46.005

Acid Dissociation Constant (pKa)

25.89

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

E727-0631 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E727-0631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E727-0631?
Check Price and Availability of E727-0631, 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 E727-0631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E727-0631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E727-0631
  • 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 E727-0631 available by request