V016-8519 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide

V016-8519 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide
V016-8519 Screening compound: 2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-8519
2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide

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

V016-8519

Molecular Formula

C21H23Cl2N3O2 (C21 H23 Cl2 N3 O2)

Compound Name

2-{2-[(2,6-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide

IUPAC name

2-{2-[(26-dichlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-(2-methoxyethyl)butanamide

SMILES

CCC(C(NCCOC)=O)n1c(cccc2)c2nc1Cc(c(Cl)ccc1)c1Cl

InChI

InChI=1S/C21H23Cl2N3O2/c1-3-18(21(27)24-11-12-28-2)26-19-10-5-4-9-17(19)25-20(26)13-14-15(22)7-6-8-16(14)23/h4-10,18H,3,11-13H2,1-2H3,(H,24,27)/t18-/m0/s1

InChI Key

CWXVFMGMUQPNQN-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19782132

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.837

Distribution Coefficient, logD

4.836

Water Solubility, LogSw

-4.75

Polar Surface Area

44.292

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

4.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V016-8519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-8519?
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What is the minimum amount of V016-8519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-8519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-8519
  • 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 V016-8519 available by request