S697-1557 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine

S697-1557 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine
S697-1557 Screening compound: 4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S697-1557
4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine

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

S697-1557

Molecular Formula

C17H25N5O (C17 H25 N5 O)

Compound Name

4-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine

IUPAC name

4-[(25-dimethyl-1H-imidazol-1-yl)methyl]-1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine

SMILES

CCn(cc1)nc1C(N1CCC(Cn2c(C)ncc2C)CC1)=O

InChI

InChI=1S/C17H25N5O/c1-4-21-10-7-16(19-21)17(23)20-8-5-15(6-9-20)12-22-13(2)11-18-14(22)3/h7,10-11,15H,4-6,8-9,12H2,1-3H3

InChI Key

HCPMYZPFVBEOEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30467712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.323

Distribution Coefficient, logD

0.408

Water Solubility, LogSw

-1.58

Polar Surface Area

43.233

Acid Dissociation Constant (pKa)

24.61

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

S697-1557 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 S697-1557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S697-1557?
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What is the minimum amount of S697-1557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S697-1557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S697-1557
  • 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 S697-1557 available by request