C614-5469 Screening compound: tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}piperidine-1-carboxylate

C614-5469 Screening compound: tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}piperidine-1-carboxylate
C614-5469 Screening compound: tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-5469
tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}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

C614-5469

Molecular Formula

C19H27N3O5 (C19 H27 N3 O5)

Compound Name

tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}piperidine-1-carboxylate

IUPAC name

tert-butyl 4-{[(2-methoxyphenyl)formohydrazido]carbonyl}piperidine-1-carboxylate

SMILES

CC(C)(C)OC(N(CC1)CCC1C(NNC(c(cccc1)c1OC)=O)=O)=O

InChI

InChI=1S/C19H27N3O5/c1-19(2,3)27-18(25)22-11-9-13(10-12-22)16(23)20-21-17(24)14-7-5-6-8-15(14)26-4/h5-8,13H,9-12H2,1-4H3,(H,20,23)(H,21,24)

InChI Key

ABSTWWFVPBSZDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776568

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.518

Distribution Coefficient, logD

2.502

Water Solubility, LogSw

-2.92

Polar Surface Area

81.147

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

4.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

C614-5469 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C614-5469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-5469?
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What is the minimum amount of C614-5469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-5469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-5469
  • 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 C614-5469 available by request