V014-4346 Screening compound: ethyl 1-[4-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate

V014-4346 Screening compound: ethyl 1-[4-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
V014-4346 Screening compound: ethyl 1-[4-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-4346
ethyl 1-[4-({[4-ethyl-6-(morpholin-4-yl)pyrimidin-2-yl]sulfanyl}methyl)benzoyl]piperidine-3-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

V014-4346

Molecular Formula

C26H34N4O4S (C26 H34 N4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCc1nc(SCc(cc2)ccc2C(N(CCC2)CC2C(OCC)=O)=O)nc(N2CCOCC2)c1

InChI

InChI=1S/C26H34N4O4S/c1-3-22-16-23(29-12-14-33-15-13-29)28-26(27-22)35-18-19-7-9-20(10-8-19)24(31)30-11-5-6-21(17-30)25(32)34-4-2/h7-10,16,21H,3-6,11-15,17-18H2,1-2H3/t21-/m0/s1

InChI Key

FSDCPRISOSBQNJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19817699

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

3.838

Distribution Coefficient, logD

3.837

Water Solubility, LogSw

-3.84

Polar Surface Area

65.915

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.80

References: we are preparing a list of scientific research reports with V014-4346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-4346?
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What is the minimum amount of V014-4346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-4346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-4346
  • 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 V014-4346 available by request