V029-5446 Screening compound: 1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine

V029-5446 Screening compound: 1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine
V029-5446 Screening compound: 1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-5446
1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine

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

V029-5446

Molecular Formula

C37H35ClN4OS (C37 H35 ClN4 OS)

Compound Name

1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine

IUPAC name

1-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[12-a]pyridin-3-yl]methyl}-4-(4-tert-butylbenzoyl)piperazine

SMILES

CC(C)(C)c(cc1)ccc1C(N1CCN(Cc2c(-c(cc3)ccc3Cl)nc(cc3)n2cc3-c2cc(cccc3)c3s2)CC1)=O

InChI

InChI=1S/C37H35ClN4OS/c1-37(2,3)29-13-8-26(9-14-29)36(43)41-20-18-40(19-21-41)24-31-35(25-10-15-30(38)16-11-25)39-34-17-12-28(23-42(31)34)33-22-27-6-4-5-7-32(27)44-33/h4-17,22-23H,18-21,24H2,1-3H3

InChI Key

VXONZKYBTZCVQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20495351

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

619.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

8.711

Distribution Coefficient, logD

8.709

Water Solubility, LogSw

-6.59

Polar Surface Area

29.162

Acid Dissociation Constant (pKa)

26.99

Base Dissociation Constant (pKb)

5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.30

References: we are preparing a list of scientific research reports with V029-5446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-5446?
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What is the minimum amount of V029-5446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-5446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-5446
  • 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 V029-5446 available by request