V029-4064 Screening compound: 3-{5,6-dichloro-2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide

V029-4064 Screening compound: 3-{5,6-dichloro-2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide
V029-4064 Screening compound: 3-{5,6-dichloro-2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4064
3-{5,6-dichloro-2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide

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

V029-4064

Molecular Formula

C23H19Cl2FN4O (C23 H19 Cl2 FN4 O)

Compound Name

3-{5,6-dichloro-2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide

IUPAC name

3-{56-dichloro-2-[(2-fluorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-[(pyridin-2-yl)methyl]propanamide

SMILES

O=C(CCn(c(Cc(cccc1)c1F)nc1c2)c1cc(Cl)c2Cl)NCc1ncccc1

InChI

InChI=1S/C23H19Cl2FN4O/c24-17-12-20-21(13-18(17)25)30(22(29-20)11-15-5-1-2-7-19(15)26)10-8-23(31)28-14-16-6-3-4-9-27-16/h1-7,9,12-13H,8,10-11,14H2,(H,28,31)

InChI Key

DRZNAUUZGXUJAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27633092

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

457.33

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

5.041

Distribution Coefficient, logD

5.041

Water Solubility, LogSw

-5.33

Polar Surface Area

44.865

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

4.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with V029-4064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4064?
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What is the minimum amount of V029-4064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4064
  • 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 V029-4064 available by request