SA23-1352 Screening compound: N-({4,4-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl}methyl)acetamide

SA23-1352 Screening compound: N-({4,4-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl}methyl)acetamide
SA23-1352 Screening compound: N-({4,4-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA23-1352
N-({4,4-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl}methyl)acetamide

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

SA23-1352

Molecular Formula

C15H19F2N5O2 (C15 H19 F2 N5 O2)

Compound Name

N-({4,4-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl}methyl)acetamide

IUPAC name

N-{[(2S)-44-difluoro-1-[1-(pyrimidine-5-carbonyl)azetidin-3-yl]pyrrolidin-2-yl]methyl}acetamide

SMILES

CC(NC[C@H](CC(C1)(F)F)N1C(C1)CN1C(c1cncnc1)=O)=O

InChI

InChI=1S/C15H19F2N5O2/c1-10(23)20-5-12-2-15(16,17)8-22(12)13-6-21(7-13)14(24)11-3-18-9-19-4-11/h3-4,9,12-13H,2,5-8H2,1H3,(H,20,23)/t12-/m1/s1

InChI Key

YYUOPRKFGKWMIF-GFCCVEGCSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-1.280

Distribution Coefficient, logD

-1.281

Water Solubility, LogSw

-0.85

Polar Surface Area

65.458

Acid Dissociation Constant (pKa)

13.99

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

SA23-1352 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 SA23-1352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA23-1352?
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What is the minimum amount of SA23-1352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA23-1352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA23-1352
  • 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 SA23-1352 available by request