5868-0480 Screening compound: 2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]acetamide

5868-0480 Screening compound: 2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]acetamide
5868-0480 Screening compound: 2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5868-0480
2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]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

5868-0480

Molecular Formula

C20H24ClN3O4 (C20 H24 ClN3 O4)

Compound Name

2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]acetamide

IUPAC name

2-[2-chloro-6-methoxy-4-({[4-(morpholin-4-yl)phenyl]amino}methyl)phenoxy]acetamide

SMILES

COc1cc(CNc(cc2)ccc2N2CCOCC2)cc(Cl)c1OCC(N)=O

InChI

InChI=1S/C20H24ClN3O4/c1-26-18-11-14(10-17(21)20(18)28-13-19(22)25)12-23-15-2-4-16(5-3-15)24-6-8-27-9-7-24/h2-5,10-11,23H,6-9,12-13H2,1H3,(H2,22,25)

InChI Key

ZYVMCLBVONNLBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03698225

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.232

Distribution Coefficient, logD

2.231

Water Solubility, LogSw

-3.23

Polar Surface Area

70.525

Acid Dissociation Constant (pKa)

15.51

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

5868-0480 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5868-0480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5868-0480?
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What is the minimum amount of 5868-0480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5868-0480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5868-0480
  • 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 5868-0480 available by request