D340-1845 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide

D340-1845 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide
D340-1845 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D340-1845
4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide

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

D340-1845

Molecular Formula

C22H27ClN4O3 (C22 H27 ClN4 O3)

Compound Name

4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide

IUPAC name

4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-cyclohexyl-1H-imidazole-5-carboxamide

SMILES

OC(CC1)(CCN1C(c1c(C(NC2CCCCC2)=O)[nH]cn1)=O)c(cc1)ccc1Cl

InChI

InChI=1S/C22H27ClN4O3/c23-16-8-6-15(7-9-16)22(30)10-12-27(13-11-22)21(29)19-18(24-14-25-19)20(28)26-17-4-2-1-3-5-17/h6-9,14,17,30H,1-5,10-13H2,(H,24,25)(H,26,28)

InChI Key

VMWIDWSIFXQINL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.93

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.415

Distribution Coefficient, logD

2.408

Water Solubility, LogSw

-3.15

Polar Surface Area

78.229

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

D340-1845 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D340-1845 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D340-1845?
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What is the minimum amount of D340-1845 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D340-1845
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D340-1845
  • 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 D340-1845 available by request