CL9902-3034 Screening compound: 1H-PYRAZOL-4-YL[(2S)-2-(5-TETRAHYDRO-2H-PYRAN-4-YL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]METHANONE

CL9902-3034 Screening compound: 1H-PYRAZOL-4-YL[(2S)-2-(5-TETRAHYDRO-2H-PYRAN-4-YL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]METHANONE
CL9902-3034 Screening compound: 1H-PYRAZOL-4-YL[(2S)-2-(5-TETRAHYDRO-2H-PYRAN-4-YL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound CL9902-3034
1H-PYRAZOL-4-YL[(2S)-2-(5-TETRAHYDRO-2H-PYRAN-4-YL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]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

CL9902-3034

Molecular Formula

C15H20N6O2 (C15 H20 N6 O2)

Compound Name

1H-PYRAZOL-4-YL[(2S)-2-(5-TETRAHYDRO-2H-PYRAN-4-YL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]METHANONE

IUPAC name

3-(oxan-4-yl)-5-[(2S)-1-(1H-pyrazole-4-carbonyl)pyrrolidin-2-yl]-4H-124-triazole

SMILES

O=C(c1c[nH]nc1)N(CCC1)[C@@H]1c1nnc(C2CCOCC2)[nH]1

InChI

InChI=1S/C15H20N6O2/c22-15(11-8-16-17-9-11)21-5-1-2-12(21)14-18-13(19-20-14)10-3-6-23-7-4-10/h8-10,12H,1-7H2,(H,16,17)(H,18,19,20)/t12-/m0/s1

InChI Key

NGLNWTPRODFWQB-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD30460167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.007

Distribution Coefficient, logD

-0.009

Water Solubility, LogSw

-0.69

Polar Surface Area

83.182

Acid Dissociation Constant (pKa)

7.53

Base Dissociation Constant (pKb)

1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

CL9902-3034 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with CL9902-3034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CL9902-3034?
Check Price and Availability of CL9902-3034, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of CL9902-3034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CL9902-3034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CL9902-3034
  • 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 CL9902-3034 available by request