D340-1861 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-1H-imidazole-5-carboxamide

D340-1861 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-1H-imidazole-5-carboxamide
D340-1861 Screening compound: 4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-1H-imidazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D340-1861
4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-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

D340-1861

Molecular Formula

C21H27ClN4O3 (C21 H27 ClN4 O3)

Compound Name

4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-1H-imidazole-5-carboxamide

IUPAC name

4-[4-(4-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-N-(3-methylbutyl)-1H-imidazole-5-carboxamide

SMILES

CC(C)CCNC(c1c(C(N(CC2)CCC2(c(cc2)ccc2Cl)O)=O)nc[nH]1)=O

InChI

InChI=1S/C21H27ClN4O3/c1-14(2)7-10-23-19(27)17-18(25-13-24-17)20(28)26-11-8-21(29,9-12-26)15-3-5-16(22)6-4-15/h3-6,13-14,29H,7-12H2,1-2H3,(H,23,27)(H,24,25)

InChI Key

ZHGWPTXLBCUPIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.239

Distribution Coefficient, logD

2.235

Water Solubility, LogSw

-3.20

Polar Surface Area

78.616

Acid Dissociation Constant (pKa)

7.14

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

D340-1861 in Drug Discovery

Included in Screening Libraries

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 D340-1861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D340-1861?
Check Price and Availability of D340-1861, 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 D340-1861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D340-1861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D340-1861
  • 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 D340-1861 available by request