V018-2495 Screening compound: 2-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]acetamide

V018-2495 Screening compound: 2-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]acetamide
V018-2495 Screening compound: 2-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-2495
2-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]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

V018-2495

Molecular Formula

C22H18Cl2N4O (C22 H18 Cl2 N4 O)

Compound Name

2-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]acetamide

IUPAC name

2-{2-[(24-dichlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-[(pyridin-4-yl)methyl]acetamide

SMILES

O=C(Cn1c(cccc2)c2nc1Cc(ccc(Cl)c1)c1Cl)NCc1ccncc1

InChI

InChI=1S/C22H18Cl2N4O/c23-17-6-5-16(18(24)12-17)11-21-27-19-3-1-2-4-20(19)28(21)14-22(29)26-13-15-7-9-25-10-8-15/h1-10,12H,11,13-14H2,(H,26,29)

InChI Key

LQDVBPJTJKNKMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19781474

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

425.32

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

4.483

Distribution Coefficient, logD

4.473

Water Solubility, LogSw

-4.54

Polar Surface Area

44.771

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

V018-2495 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V018-2495 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-2495?
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What is the minimum amount of V018-2495 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-2495
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-2495
  • 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 V018-2495 available by request