V020-9222 Screening compound: N-butyl-2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carboxamide

V020-9222 Screening compound: N-butyl-2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carboxamide
V020-9222 Screening compound: N-butyl-2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9222
N-butyl-2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carboxamide

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

V020-9222

Molecular Formula

C26H32FN3O3S (C26 H32 FN3 O3 S)

Compound Name

N-butyl-2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carboxamide

IUPAC name

N-butyl-2-({[2-(34-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-13-thiazole-4-carboxamide

SMILES

CCCCNC(c1csc(CN(CCc(cc2)cc(OC)c2OC)Cc(cc2)ccc2F)n1)=O

InChI

InChI=1S/C26H32FN3O3S/c1-4-5-13-28-26(31)22-18-34-25(29-22)17-30(16-20-6-9-21(27)10-7-20)14-12-19-8-11-23(32-2)24(15-19)33-3/h6-11,15,18H,4-5,12-14,16-17H2,1-3H3,(H,28,31)

InChI Key

HLHQJBJSUJZCMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19767158

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.699

Distribution Coefficient, logD

4.699

Water Solubility, LogSw

-4.44

Polar Surface Area

53.945

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V020-9222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9222?
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What is the minimum amount of V020-9222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9222
  • 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 V020-9222 available by request