V004-1629 Screening compound: 2-{5,6-dichloro-2-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-methyl-N-propylacetamide

V004-1629 Screening compound: 2-{5,6-dichloro-2-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-methyl-N-propylacetamide
V004-1629 Screening compound: 2-{5,6-dichloro-2-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-methyl-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1629
2-{5,6-dichloro-2-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-methyl-N-propylacetamide

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

V004-1629

Molecular Formula

C20H20Cl2FN3O (C20 H20 Cl2 FN3 O)

Compound Name

2-{5,6-dichloro-2-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-methyl-N-propylacetamide

IUPAC name

2-{56-dichloro-2-[(4-fluorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-methyl-N-propylacetamide

SMILES

CCCN(C)C(Cn(c(Cc(cc1)ccc1F)nc1c2)c1cc(Cl)c2Cl)=O

InChI

InChI=1S/C20H20Cl2FN3O/c1-3-8-25(2)20(27)12-26-18-11-16(22)15(21)10-17(18)24-19(26)9-13-4-6-14(23)7-5-13/h4-7,10-11H,3,8-9,12H2,1-2H3

InChI Key

YFRLRFLWMSOZFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27498813

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

408.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.938

Distribution Coefficient, logD

4.886

Water Solubility, LogSw

-4.99

Polar Surface Area

27.016

Acid Dissociation Constant (pKa)

16.84

Base Dissociation Constant (pKb)

6.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with V004-1629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1629?
Check Price and Availability of V004-1629, 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 V004-1629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1629
  • 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 V004-1629 available by request