V030-1686 Screening compound: 2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine

V030-1686 Screening compound: 2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine
V030-1686 Screening compound: 2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-1686
2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine

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

V030-1686

Molecular Formula

C22H29FN4O2S (C22 H29 FN4 O2 S)

Compound Name

2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine

IUPAC name

2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-[(4-fluorophenyl)methyl]pyrimidine

SMILES

CCc1c(Cc(cc2)ccc2F)c(N(CC2)CCN2S(CC)(=O)=O)nc(C2CC2)n1

InChI

InChI=1S/C22H29FN4O2S/c1-3-20-19(15-16-5-9-18(23)10-6-16)22(25-21(24-20)17-7-8-17)26-11-13-27(14-12-26)30(28,29)4-2/h5-6,9-10,17H,3-4,7-8,11-15H2,1-2H3

InChI Key

AQLYUHLGYVAJOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497952

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

432.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.475

Distribution Coefficient, logD

3.389

Water Solubility, LogSw

-4.27

Polar Surface Area

55.126

Acid Dissociation Constant (pKa)

20.95

Base Dissociation Constant (pKb)

8.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

V030-1686 in Drug Discovery

Included in Screening Libraries

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V030-1686 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-1686?
Check Price and Availability of V030-1686, 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 V030-1686 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-1686
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-1686
  • 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 V030-1686 available by request