SB34-1238 Screening compound: 1-[(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl]-2-(3-methoxyphenyl)-1-ethanone

SB34-1238 Screening compound: 1-[(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl]-2-(3-methoxyphenyl)-1-ethanone
SB34-1238 Screening compound: 1-[(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl]-2-(3-methoxyphenyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB34-1238
1-[(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl]-2-(3-methoxyphenyl)-1-ethanone

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

SB34-1238

Molecular Formula

C17H21FN4O2 (C17 H21 FN4 O2)

Compound Name

1-[(3S,4S)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)tetrahydro-1H-pyrrol-1-yl]-2-(3-methoxyphenyl)-1-ethanone

IUPAC name

1-[(3S4S)-3-(fluoromethyl)-4-(3-methyl-1H-124-triazol-5-yl)pyrrolidin-1-yl]-2-(3-methoxyphenyl)ethan-1-one

SMILES

Cc1n[nH]c([C@@H](C2)[C@@H](CF)CN2C(Cc2cc(OC)ccc2)=O)n1

InChI

InChI=1S/C17H21FN4O2/c1-11-19-17(21-20-11)15-10-22(9-13(15)8-18)16(23)7-12-4-3-5-14(6-12)24-2/h3-6,13,15H,7-10H2,1-2H3,(H,19,20,21)/t13-,15-/m0/s1

InChI Key

PAQCVPNWIUSBAL-ZFWWWQNUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.469

Distribution Coefficient, logD

1.468

Water Solubility, LogSw

-2.27

Polar Surface Area

57.534

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

47.06

References: we are preparing a list of scientific research reports with SB34-1238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB34-1238?
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What is the minimum amount of SB34-1238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB34-1238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB34-1238
  • 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 SB34-1238 available by request