P768-0233 Screening compound: N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

P768-0233 Screening compound: N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide
P768-0233 Screening compound: N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P768-0233
N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazole-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

P768-0233

Molecular Formula

C21H23ClN4O (C21 H23 ClN4 O)

Compound Name

N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

N-[(4-chlorophenyl)methyl]-1-[2-(pyrrolidin-1-yl)ethyl]-1H-13-benzodiazole-5-carboxamide

SMILES

O=C(c(cc1)cc2c1n(CCN1CCCC1)cn2)NCc(cc1)ccc1Cl

InChI

InChI=1S/C21H23ClN4O/c22-18-6-3-16(4-7-18)14-23-21(27)17-5-8-20-19(13-17)24-15-26(20)12-11-25-9-1-2-10-25/h3-8,13,15H,1-2,9-12,14H2,(H,23,27)

InChI Key

RNPGTGMSCULYFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.877

Distribution Coefficient, logD

1.856

Water Solubility, LogSw

-3.64

Polar Surface Area

39.163

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

8.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

P768-0233 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with P768-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P768-0233?
Check Price and Availability of P768-0233, 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 P768-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P768-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P768-0233
  • 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 P768-0233 available by request