P035-0196 Screening compound: N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide

P035-0196 Screening compound: N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide
P035-0196 Screening compound: N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P035-0196
N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide

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

P035-0196

Molecular Formula

C21H21ClN6O2 (C21 H21 ClN6 O2)

Compound Name

N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide

IUPAC name

N-(6-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1H-imidazol-1-yl}pyridin-3-yl)acetamide

SMILES

CC(Nc(cc1)cnc1-n1cnc(C(N(CC2)CCN2c(cc2)ccc2Cl)=O)c1)=O

InChI

InChI=1S/C21H21ClN6O2/c1-15(29)25-17-4-7-20(23-12-17)28-13-19(24-14-28)21(30)27-10-8-26(9-11-27)18-5-2-16(22)3-6-18/h2-7,12-14H,8-11H2,1H3,(H,25,29)

InChI Key

NNGAKQNJCUEUSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.919

Distribution Coefficient, logD

2.918

Water Solubility, LogSw

-3.36

Polar Surface Area

64.248

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

P035-0196 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with P035-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P035-0196?
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What is the minimum amount of P035-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P035-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P035-0196
  • 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 P035-0196 available by request