G397-1592 Screening compound: N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

G397-1592 Screening compound: N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
G397-1592 Screening compound: N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G397-1592
N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

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

G397-1592

Molecular Formula

C21H27N5O3S (C21 H27 N5 O3 S)

Compound Name

N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-1-[5-(2-oxopiperidin-1-yl)-134-thiadiazol-2-yl]piperidine-4-carboxamide

SMILES

COc1cccc(CNC(C(CC2)CCN2c2nnc(N(CCCC3)C3=O)s2)=O)c1

InChI

InChI=1S/C21H27N5O3S/c1-29-17-6-4-5-15(13-17)14-22-19(28)16-8-11-25(12-9-16)20-23-24-21(30-20)26-10-3-2-7-18(26)27/h4-6,13,16H,2-3,7-12,14H2,1H3,(H,22,28)

InChI Key

URKUFRAKMJDWOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15009075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.248

Distribution Coefficient, logD

2.248

Water Solubility, LogSw

-2.72

Polar Surface Area

75.232

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

References: we are preparing a list of scientific research reports with G397-1592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G397-1592?
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What is the minimum amount of G397-1592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G397-1592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G397-1592
  • 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 G397-1592 available by request