L532-1458 Screening compound: 4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile

L532-1458 Screening compound: 4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
L532-1458 Screening compound: 4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound L532-1458
4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile

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

L532-1458

Molecular Formula

C28H31N7S (C28 H31 N7 S)

Compound Name

4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile

IUPAC name

4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[21-b][134]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile

SMILES

Cc1cccc(-c2c(NC3CCCC3)n3nc(N4CCN(Cc(cc5)ccc5C#N)CC4)sc3n2)c1

InChI

InChI=1S/C28H31N7S/c1-20-5-4-6-23(17-20)25-26(30-24-7-2-3-8-24)35-27(31-25)36-28(32-35)34-15-13-33(14-16-34)19-22-11-9-21(18-29)10-12-22/h4-6,9-12,17,24,30H,2-3,7-8,13-16,19H2,1H3

InChI Key

KHVQEGHHYZZQOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27459910

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.67

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.460

Distribution Coefficient, logD

5.403

Water Solubility, LogSw

-5.52

Polar Surface Area

55.373

Acid Dissociation Constant (pKa)

23.03

Base Dissociation Constant (pKb)

6.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with L532-1458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L532-1458?
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What is the minimum amount of L532-1458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L532-1458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L532-1458
  • 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 L532-1458 available by request