SB92-0771 Screening compound: N-[1-(2,4-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide

SB92-0771 Screening compound: N-[1-(2,4-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide
SB92-0771 Screening compound: N-[1-(2,4-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB92-0771
N-[1-(2,4-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide

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

SB92-0771

Molecular Formula

C17H23F2N3O3S (C17 H23 F2 N3 O3 S)

Compound Name

N-[1-(2,4-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide

IUPAC name

N-[1-(24-difluorobenzoyl)azetidin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]methanesulfonamide

SMILES

CS(N(CCN1CCCC1)C(C1)CN1C(c(ccc(F)c1)c1F)=O)(=O)=O

InChI

InChI=1S/C17H23F2N3O3S/c1-26(24,25)22(9-8-20-6-2-3-7-20)14-11-21(12-14)17(23)15-5-4-13(18)10-16(15)19/h4-5,10,14H,2-3,6-9,11-12H2,1H3

InChI Key

WUKZTVFADQNLSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32249856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.240

Distribution Coefficient, logD

1.036

Water Solubility, LogSw

-2.38

Polar Surface Area

52.370

Acid Dissociation Constant (pKa)

24.79

Base Dissociation Constant (pKb)

7.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

SB92-0771 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB92-0771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB92-0771?
Check Price and Availability of SB92-0771, 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 SB92-0771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB92-0771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB92-0771
  • 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 SB92-0771 available by request