L327-4798 Screening compound: 3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}propan-1-one

L327-4798 Screening compound: 3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}propan-1-one
L327-4798 Screening compound: 3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L327-4798
3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}propan-1-one

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

L327-4798

Molecular Formula

C27H36N6OS (C27 H36 N6 OS)

Compound Name

3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}propan-1-one

IUPAC name

3-cyclopentyl-1-{4-[5-(cyclopentylamino)-6-phenylimidazo[21-b][134]thiadiazol-2-yl]piperazin-1-yl}propan-1-one

SMILES

O=C(CCC1CCCC1)N(CC1)CCN1c(s1)nn2c1nc(-c1ccccc1)c2NC1CCCC1

InChI

InChI=1S/C27H36N6OS/c34-23(15-14-20-8-4-5-9-20)31-16-18-32(19-17-31)27-30-33-25(28-22-12-6-7-13-22)24(29-26(33)35-27)21-10-2-1-3-11-21/h1-3,10-11,20,22,28H,4-9,12-19H2

InChI Key

RYVILBNDQPRBMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27245871

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.69

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.296

Distribution Coefficient, logD

5.296

Water Solubility, LogSw

-5.59

Polar Surface Area

51.263

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.30

L327-4798 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L327-4798 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L327-4798?
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What is the minimum amount of L327-4798 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L327-4798
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L327-4798
  • 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 L327-4798 available by request