V029-8164 Screening compound: 3-{5,6-dichloro-2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(furan-2-yl)methyl]propanamide

V029-8164 Screening compound: 3-{5,6-dichloro-2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(furan-2-yl)methyl]propanamide
V029-8164 Screening compound: 3-{5,6-dichloro-2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(furan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-8164
3-{5,6-dichloro-2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-[(furan-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

V029-8164

Molecular Formula

C22H18Cl3N3O2 (C22 H18 Cl3 N3 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCn(c(Cc(cccc1)c1Cl)nc1c2)c1cc(Cl)c2Cl)NCc1ccco1

InChI

InChI=1S/C22H18Cl3N3O2/c23-16-6-2-1-4-14(16)10-21-27-19-11-17(24)18(25)12-20(19)28(21)8-7-22(29)26-13-15-5-3-9-30-15/h1-6,9,11-12H,7-8,10,13H2,(H,26,29)

InChI Key

UMOUNDZKOABQFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27633491

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

462.76

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

6.181

Distribution Coefficient, logD

6.180

Water Solubility, LogSw

-6.27

Polar Surface Area

43.070

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

4.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with V029-8164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-8164?
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What is the minimum amount of V029-8164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-8164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-8164
  • 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 V029-8164 available by request