V013-1360 Screening compound: ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate

V013-1360 Screening compound: ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate
V013-1360 Screening compound: ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-1360
ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate

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

V013-1360

Molecular Formula

C26H34N4O4S (C26 H34 N4 O4 S)

Compound Name

ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[3-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-4-carboxylate

SMILES

CCc1nc(SCc2cc(C(N(CC3)CCC3C(OCC)=O)=O)ccc2)nc(N2CCOCC2)c1

InChI

InChI=1S/C26H34N4O4S/c1-3-22-17-23(29-12-14-33-15-13-29)28-26(27-22)35-18-19-6-5-7-21(16-19)24(31)30-10-8-20(9-11-30)25(32)34-4-2/h5-7,16-17,20H,3-4,8-15,18H2,1-2H3

InChI Key

MLGAHNRAFRYQPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19818031

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

498.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.009

Distribution Coefficient, logD

4.009

Water Solubility, LogSw

-3.94

Polar Surface Area

65.982

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

V013-1360 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 V013-1360 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-1360?
Check Price and Availability of V013-1360, 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 V013-1360 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-1360
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-1360
  • 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 V013-1360 available by request