SB21-1151 Screening compound: ((2S,4S)-4-fluoro-2-{[4-(1-pyrrolidinylcarbonyl)-1H-1,2,3-triazol-1-yl]methyl}tetrahydro-1H-pyrrol-1-yl)(4-methoxy-2-methylphenyl)methanone

SB21-1151 Screening compound: ((2S,4S)-4-fluoro-2-{[4-(1-pyrrolidinylcarbonyl)-1H-1,2,3-triazol-1-yl]methyl}tetrahydro-1H-pyrrol-1-yl)(4-methoxy-2-methylphenyl)methanone
SB21-1151 Screening compound: ((2S,4S)-4-fluoro-2-{[4-(1-pyrrolidinylcarbonyl)-1H-1,2,3-triazol-1-yl]methyl}tetrahydro-1H-pyrrol-1-yl)(4-methoxy-2-methylphenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB21-1151
((2S,4S)-4-fluoro-2-{[4-(1-pyrrolidinylcarbonyl)-1H-1,2,3-triazol-1-yl]methyl}tetrahydro-1H-pyrrol-1-yl)(4-methoxy-2-methylphenyl)methanone

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

SB21-1151

Molecular Formula

C21H26FN5O3 (C21 H26 FN5 O3)

Compound Name

((2S,4S)-4-fluoro-2-{[4-(1-pyrrolidinylcarbonyl)-1H-1,2,3-triazol-1-yl]methyl}tetrahydro-1H-pyrrol-1-yl)(4-methoxy-2-methylphenyl)methanone

IUPAC name

1-{[(2S4S)-4-fluoro-1-(4-methoxy-2-methylbenzoyl)pyrrolidin-2-yl]methyl}-4-(pyrrolidine-1-carbonyl)-1H-123-triazole

SMILES

Cc(cc(cc1)OC)c1C(N(C1)[C@H](Cn2nnc(C(N3CCCC3)=O)c2)C[C@@H]1F)=O

InChI

InChI=1S/C21H26FN5O3/c1-14-9-17(30-2)5-6-18(14)20(28)27-11-15(22)10-16(27)12-26-13-19(23-24-26)21(29)25-7-3-4-8-25/h5-6,9,13,15-16H,3-4,7-8,10-12H2,1-2H3/t15-,16+/m0/s1

InChI Key

MAZBVEOWWJJDON-JKSUJKDBSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.970

Distribution Coefficient, logD

1.970

Water Solubility, LogSw

-2.44

Polar Surface Area

67.904

Acid Dissociation Constant (pKa)

24.91

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.38

References: we are preparing a list of scientific research reports with SB21-1151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB21-1151?
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What is the minimum amount of SB21-1151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB21-1151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB21-1151
  • 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 SB21-1151 available by request