2681-3618 Screening compound: (4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one

2681-3618 Screening compound: (4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one
2681-3618 Screening compound: (4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2681-3618
(4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one

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

2681-3618

Molecular Formula

C24H18ClN3O5 (C24 H18 ClN3 O5)

Compound Name

(4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-4,5-dihydro-1H-imidazol-5-one

IUPAC name

(4Z)-1-(4-chloro-3-nitrophenyl)-2-(3-methoxyphenyl)-4-[(2-methoxyphenyl)methylidene]-45-dihydro-1H-imidazol-5-one

SMILES

COc1cccc(C(N(C2=O)c(cc3)cc([N+]([O-])=O)c3Cl)=N/C2=C\c(cccc2)c2OC)c1

InChI

InChI=1S/C24H18ClN3O5/c1-32-18-8-5-7-16(12-18)23-26-20(13-15-6-3-4-9-22(15)33-2)24(29)27(23)17-10-11-19(25)21(14-17)28(30)31/h3-14H,1-2H3

InChI Key

ZURWLZIGEXYGHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01843144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.88

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.057

Distribution Coefficient, logD

5.057

Water Solubility, LogSw

-5.48

Polar Surface Area

73.183

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 2681-3618 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2681-3618?
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What is the minimum amount of 2681-3618 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2681-3618
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2681-3618
  • 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 2681-3618 available by request