P930-1181 Screening compound: 1-[(2S)-2-(5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-3-PIPERIDINO-1-PROPANONE

P930-1181 Screening compound: 1-[(2S)-2-(5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-3-PIPERIDINO-1-PROPANONE
P930-1181 Screening compound: 1-[(2S)-2-(5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-3-PIPERIDINO-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P930-1181
1-[(2S)-2-(5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-3-PIPERIDINO-1-PROPANONE

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

P930-1181

Molecular Formula

C20H27N5O (C20 H27 N5 O)

Compound Name

1-[(2S)-2-(5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-3-PIPERIDINO-1-PROPANONE

IUPAC name

n/a

SMILES

O=C(CCN1CCCCC1)N(CCC1)[C@@H]1c1nnc(-c2ccccc2)[nH]1

InChI

InChI=1S/C20H27N5O/c26-18(11-15-24-12-5-2-6-13-24)25-14-7-10-17(25)20-21-19(22-23-20)16-8-3-1-4-9-16/h1,3-4,8-9,17H,2,5-7,10-15H2,(H,21,22,23)/t17-/m0/s1

InChI Key

YECWNDCPYKFXLH-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.47

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

1.850

Distribution Coefficient, logD

-0.159

Water Solubility, LogSw

-2.16

Polar Surface Area

53.915

Acid Dissociation Constant (pKa)

4.97

Base Dissociation Constant (pKb)

9.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

P930-1181 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with P930-1181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P930-1181?
Check Price and Availability of P930-1181, 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 P930-1181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P930-1181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P930-1181
  • 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 P930-1181 available by request