SC46-0278 Screening compound: 4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane

SC46-0278 Screening compound: 4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane
SC46-0278 Screening compound: 4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane alternative view

Chemical Structure Depiction of ChemDiv screening compound SC46-0278
4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane

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

SC46-0278

Molecular Formula

C19H28N6O2S (C19 H28 N6 O2 S)

Compound Name

4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane

IUPAC name

4-(3-cyclopropyl-1H-124-triazol-5-yl)-2-[(135-trimethyl-1H-pyrazol-4-yl)sulfonyl]-2-azaspiro[4.4]nonane

SMILES

Cc(n(C)nc1C)c1S(N(C1)CC2(CCCC2)C1c1nc(C2CC2)n[nH]1)(=O)=O

InChI

InChI=1S/C19H28N6O2S/c1-12-16(13(2)24(3)23-12)28(26,27)25-10-15(19(11-25)8-4-5-9-19)18-20-17(21-22-18)14-6-7-14/h14-15H,4-11H2,1-3H3,(H,20,21,22)/t15-/m0/s1

InChI Key

QVRXYOCJVHQFQY-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.249

Distribution Coefficient, logD

1.243

Water Solubility, LogSw

-1.94

Polar Surface Area

81.345

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.68

References: we are preparing a list of scientific research reports with SC46-0278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC46-0278?
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What is the minimum amount of SC46-0278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC46-0278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC46-0278
  • 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 SC46-0278 available by request