4464-0969 Screening compound: tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate

4464-0969 Screening compound: tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate
4464-0969 Screening compound: tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4464-0969
tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate

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

4464-0969

Molecular Formula

C21H34N4O5 (C21 H34 N4 O5)

Compound Name

tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate

IUPAC name

tert-butyl N-[2-(benzyloxy)-1-{[1-(hydrazinecarbonyl)-3-methylbutyl]carbamoyl}ethyl]carbamate

SMILES

CC(C)CC(C(NN)=O)NC(C(COCc1ccccc1)NC(OC(C)(C)C)=O)=O

InChI

InChI=1S/C21H34N4O5/c1-14(2)11-16(19(27)25-22)23-18(26)17(24-20(28)30-21(3,4)5)13-29-12-15-9-7-6-8-10-15/h6-10,14,16-17H,11-13,22H2,1-5H3,(H,23,26)(H,24,28)(H,25,27)

InChI Key

IYCZMJMNVSEOOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00619128

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.567

Distribution Coefficient, logD

2.567

Water Solubility, LogSw

-2.74

Polar Surface Area

113.399

Acid Dissociation Constant (pKa)

12.72

Base Dissociation Constant (pKb)

3.42

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

57.10

4464-0969 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Autophagy-Targeted Library (4564 compounds)

CORONAVIRUS Library (20774 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4464-0969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4464-0969?
Check Price and Availability of 4464-0969, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4464-0969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4464-0969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4464-0969
  • 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 4464-0969 available by request