SA23-0085 Screening compound: ({1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methyl)dimethylamine

SA23-0085 Screening compound: ({1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methyl)dimethylamine
SA23-0085 Screening compound: ({1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methyl)dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA23-0085
({1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methyl)dimethylamine

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

SA23-0085

Molecular Formula

C16H25F2N5O (C16 H25 F2 N5 O)

Compound Name

({1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methyl)dimethylamine

IUPAC name

{[(2S)-1-[1-(1-ethyl-1H-pyrazole-3-carbonyl)azetidin-3-yl]-44-difluoropyrrolidin-2-yl]methyl}dimethylamine

SMILES

CCn(cc1)nc1C(N(C1)CC1N(C1)[C@H](CN(C)C)CC1(F)F)=O

InChI

InChI=1S/C16H25F2N5O/c1-4-22-6-5-14(19-22)15(24)21-9-13(10-21)23-11-16(17,18)7-12(23)8-20(2)3/h5-6,12-13H,4,7-11H2,1-3H3/t12-/m1/s1

InChI Key

QMKRGGGDHVNVDG-GFCCVEGCSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.490

Distribution Coefficient, logD

0.484

Water Solubility, LogSw

-1.56

Polar Surface Area

38.396

Acid Dissociation Constant (pKa)

27.13

Base Dissociation Constant (pKb)

5.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

75.00

References: we are preparing a list of scientific research reports with SA23-0085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA23-0085?
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What is the minimum amount of SA23-0085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA23-0085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA23-0085
  • 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 SA23-0085 available by request