SB34-1135 Screening compound: 3-cyclohexyl-5-{(3S,4S)-4-(fluoromethyl)-1-[(5-methyl-2-furyl)methyl]tetrahydro-1H-pyrrol-3-yl}-1H-1,2,4-triazole

SB34-1135 Screening compound: 3-cyclohexyl-5-{(3S,4S)-4-(fluoromethyl)-1-[(5-methyl-2-furyl)methyl]tetrahydro-1H-pyrrol-3-yl}-1H-1,2,4-triazole
SB34-1135 Screening compound: 3-cyclohexyl-5-{(3S,4S)-4-(fluoromethyl)-1-[(5-methyl-2-furyl)methyl]tetrahydro-1H-pyrrol-3-yl}-1H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SB34-1135
3-cyclohexyl-5-{(3S,4S)-4-(fluoromethyl)-1-[(5-methyl-2-furyl)methyl]tetrahydro-1H-pyrrol-3-yl}-1H-1,2,4-triazole

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

SB34-1135

Molecular Formula

C19H27FN4O (C19 H27 FN4 O)

Compound Name

3-cyclohexyl-5-{(3S,4S)-4-(fluoromethyl)-1-[(5-methyl-2-furyl)methyl]tetrahydro-1H-pyrrol-3-yl}-1H-1,2,4-triazole

IUPAC name

3-cyclohexyl-5-[(3S4S)-4-(fluoromethyl)-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-yl]-1H-124-triazole

SMILES

Cc1ccc(CN(C[C@@H]2CF)C[C@@H]2c2nc(C3CCCCC3)n[nH]2)o1

InChI

InChI=1S/C19H27FN4O/c1-13-7-8-16(25-13)11-24-10-15(9-20)17(12-24)19-21-18(22-23-19)14-5-3-2-4-6-14/h7-8,14-15,17H,2-6,9-12H2,1H3,(H,21,22,23)/t15-,17-/m0/s1

InChI Key

JZXQIKOBQORYCY-RDJZCZTQSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.528

Distribution Coefficient, logD

0.765

Water Solubility, LogSw

-3.67

Polar Surface Area

45.172

Acid Dissociation Constant (pKa)

8.42

Base Dissociation Constant (pKb)

9.66

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.42

SB34-1135 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB34-1135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB34-1135?
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What is the minimum amount of SB34-1135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB34-1135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB34-1135
  • 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 SB34-1135 available by request