C614-5454 Screening compound: tert-butyl 4-[N'-(2,4-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate

C614-5454 Screening compound: tert-butyl 4-[N'-(2,4-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate
C614-5454 Screening compound: tert-butyl 4-[N'-(2,4-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-5454
tert-butyl 4-[N'-(2,4-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate

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

C614-5454

Molecular Formula

C18H23Cl2N3O4 (C18 H23 Cl2 N3 O4)

Compound Name

tert-butyl 4-[N'-(2,4-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate

IUPAC name

tert-butyl 4-[N'-(24-dichlorobenzoyl)hydrazinecarbonyl]piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1C(NNC(c(ccc(Cl)c1)c1Cl)=O)=O)=O

InChI

InChI=1S/C18H23Cl2N3O4/c1-18(2,3)27-17(26)23-8-6-11(7-9-23)15(24)21-22-16(25)13-5-4-12(19)10-14(13)20/h4-5,10-11H,6-9H2,1-3H3,(H,21,24)(H,22,25)

InChI Key

ICXBKPARBXNDDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.868

Distribution Coefficient, logD

3.810

Water Solubility, LogSw

-4.46

Polar Surface Area

73.517

Acid Dissociation Constant (pKa)

8.24

Base Dissociation Constant (pKb)

4.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C614-5454 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C614-5454 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-5454?
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What is the minimum amount of C614-5454 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-5454
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-5454
  • 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 C614-5454 available by request