1502-1397 Screening compound: N-[(2E,4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-2,4-dien-2-yl]-4-nitrobenzamide

1502-1397 Screening compound: N-[(2E,4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-2,4-dien-2-yl]-4-nitrobenzamide
1502-1397 Screening compound: N-[(2E,4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-2,4-dien-2-yl]-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1502-1397
N-[(2E,4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-2,4-dien-2-yl]-4-nitrobenzamide

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

1502-1397

Molecular Formula

C22H21N3O5 (C22 H21 N3 O5)

Compound Name

N-[(2E,4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-2,4-dien-2-yl]-4-nitrobenzamide

IUPAC name

N-[(2E4E)-1-(morpholin-4-yl)-1-oxo-5-phenylpenta-24-dien-2-yl]-4-nitrobenzamide

SMILES

[O-][N+](c(cc1)ccc1C(N/C(/C(N1CCOCC1)=O)=C/C=C/c1ccccc1)=O)=O

InChI

InChI=1S/C22H21N3O5/c26-21(18-9-11-19(12-10-18)25(28)29)23-20(22(27)24-13-15-30-16-14-24)8-4-7-17-5-2-1-3-6-17/h1-12H,13-16H2,(H,23,26)

InChI Key

OGCVISLADABBGE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.161

Distribution Coefficient, logD

1.345

Water Solubility, LogSw

-3.41

Polar Surface Area

80.101

Acid Dissociation Constant (pKa)

5.59

Base Dissociation Constant (pKb)

3.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 1502-1397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1502-1397?
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What is the minimum amount of 1502-1397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1502-1397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1502-1397
  • 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 1502-1397 available by request