V025-1657 Screening compound: 4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide

V025-1657 Screening compound: 4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide
V025-1657 Screening compound: 4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-1657
4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide

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

V025-1657

Molecular Formula

C27H31FN4O (C27 H31 FN4 O)

Compound Name

4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide

IUPAC name

4-(4-benzylpiperidin-1-yl)-N-(butan-2-yl)-2-(4-fluorophenyl)pyrimidine-5-carboxamide

SMILES

CCC(C)NC(c1c(N2CCC(Cc3ccccc3)CC2)nc(-c(cc2)ccc2F)nc1)=O

InChI

InChI=1S/C27H31FN4O/c1-3-19(2)30-27(33)24-18-29-25(22-9-11-23(28)12-10-22)31-26(24)32-15-13-21(14-16-32)17-20-7-5-4-6-8-20/h4-12,18-19,21H,3,13-17H2,1-2H3,(H,30,33)/t19-/m0/s1

InChI Key

MXSAFVVHHLXBDE-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14254817

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

446.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.261

Distribution Coefficient, logD

6.261

Water Solubility, LogSw

-5.57

Polar Surface Area

46.300

Acid Dissociation Constant (pKa)

13.54

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

V025-1657 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V025-1657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-1657?
Check Price and Availability of V025-1657, 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 V025-1657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-1657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-1657
  • 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 V025-1657 available by request