SB93-0264 Screening compound: N-[1-(3-chloro-4-fluorobenzoyl)-4-piperidyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-N'-propylurea

SB93-0264 Screening compound: N-[1-(3-chloro-4-fluorobenzoyl)-4-piperidyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-N'-propylurea
SB93-0264 Screening compound: N-[1-(3-chloro-4-fluorobenzoyl)-4-piperidyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-N'-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound SB93-0264
N-[1-(3-chloro-4-fluorobenzoyl)-4-piperidyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-N'-propylurea

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

SB93-0264

Molecular Formula

C22H29ClFN5O2 (C22 H29 ClFN5 O2)

Compound Name

N-[1-(3-chloro-4-fluorobenzoyl)-4-piperidyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-N'-propylurea

IUPAC name

1-[1-(3-chloro-4-fluorobenzoyl)piperidin-4-yl]-1-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-3-propylurea

SMILES

CCCNC(N(CCn1c(C)ncc1)C(CC1)CCN1C(c(cc1)cc(Cl)c1F)=O)=O

InChI

InChI=1S/C22H29ClFN5O2/c1-3-8-26-22(31)29(14-13-27-12-9-25-16(27)2)18-6-10-28(11-7-18)21(30)17-4-5-20(24)19(23)15-17/h4-5,9,12,15,18H,3,6-8,10-11,13-14H2,1-2H3,(H,26,31)

InChI Key

KDPDHSIZNRQBCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32250561

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.795

Distribution Coefficient, logD

1.886

Water Solubility, LogSw

-3.54

Polar Surface Area

54.650

Acid Dissociation Constant (pKa)

17.10

Base Dissociation Constant (pKb)

8.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

SB93-0264 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB93-0264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB93-0264?
Check Price and Availability of SB93-0264, 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 SB93-0264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB93-0264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB93-0264
  • 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 SB93-0264 available by request