V025-1670 Screening compound: N,N-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide

V025-1670 Screening compound: N,N-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide
V025-1670 Screening compound: N,N-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-1670
N,N-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide

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

V025-1670

Molecular Formula

C32H37FN4O3 (C32 H37 FN4 O3)

Compound Name

N,N-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide

IUPAC name

NN-diethyl-5-(2-fluorobenzamido)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]benzamide

SMILES

CCC(C(N(CC1)CCN1c(ccc(NC(c(cccc1)c1F)=O)c1)c1C(N(CC)CC)=O)=O)c1ccccc1

InChI

InChI=1S/C32H37FN4O3/c1-4-25(23-12-8-7-9-13-23)31(39)37-20-18-36(19-21-37)29-17-16-24(22-27(29)32(40)35(5-2)6-3)34-30(38)26-14-10-11-15-28(26)33/h7-17,22,25H,4-6,18-21H2,1-3H3,(H,34,38)/t25-/m1/s1

InChI Key

HBYQIQFJFCUKPU-RUZDIDTESA-N

MDL Number (MFCD)

MFCD14253751

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

544.67

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.982

Distribution Coefficient, logD

4.982

Water Solubility, LogSw

-4.57

Polar Surface Area

58.869

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

6.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.40

V025-1670 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V025-1670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-1670?
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What is the minimum amount of V025-1670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-1670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-1670
  • 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 V025-1670 available by request