L383-0897 Screening compound: N-cyclopentyl-2-({6-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide

L383-0897 Screening compound: N-cyclopentyl-2-({6-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide
L383-0897 Screening compound: N-cyclopentyl-2-({6-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L383-0897
N-cyclopentyl-2-({6-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide

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

L383-0897

Molecular Formula

C23H31N5OS (C23 H31 N5 OS)

Compound Name

N-cyclopentyl-2-({6-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide

IUPAC name

N-cyclopentyl-2-({6-[4-(25-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide

SMILES

Cc1cc(N(CC2)CCN2c(cc2)nnc2SCC(NC2CCCC2)=O)c(C)cc1

InChI

InChI=1S/C23H31N5OS/c1-17-7-8-18(2)20(15-17)27-11-13-28(14-12-27)21-9-10-23(26-25-21)30-16-22(29)24-19-5-3-4-6-19/h7-10,15,19H,3-6,11-14,16H2,1-2H3,(H,24,29)

InChI Key

TWXJTLFKEQJZDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27249042

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.604

Distribution Coefficient, logD

4.604

Water Solubility, LogSw

-4.35

Polar Surface Area

51.509

Acid Dissociation Constant (pKa)

16.34

Base Dissociation Constant (pKb)

5.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

L383-0897 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 L383-0897 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L383-0897?
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What is the minimum amount of L383-0897 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L383-0897
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L383-0897
  • 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 L383-0897 available by request