E002-0727 Screening compound: 4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

E002-0727 Screening compound: 4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide
E002-0727 Screening compound: 4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-0727
4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

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

E002-0727

Molecular Formula

C19H18ClN3O3 (C19 H18 ClN3 O3)

Compound Name

4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

IUPAC name

4-(6-chloro-1H-indazol-1-yl)-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

SMILES

COc1c(CNC(CCC(n2ncc(cc3)c2cc3Cl)=O)=O)cccc1

InChI

InChI=1S/C19H18ClN3O3/c1-26-17-5-3-2-4-14(17)11-21-18(24)8-9-19(25)23-16-10-15(20)7-6-13(16)12-22-23/h2-7,10,12H,8-9,11H2,1H3,(H,21,24)

InChI Key

WIYMHRCZOYNFKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14834751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.82

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.942

Distribution Coefficient, logD

2.942

Water Solubility, LogSw

-3.44

Polar Surface Area

58.577

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with E002-0727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-0727?
Check Price and Availability of E002-0727, 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 E002-0727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-0727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-0727
  • 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 E002-0727 available by request