G015-1063 Screening compound: N-BENZYL-N-METHYL-1-[5-(PIPERIDIN-1-YL)-1,3,4-THIADIAZOL-2-YL]-1H-PYRROLE-2-CARBOXAMIDE

G015-1063 Screening compound: N-BENZYL-N-METHYL-1-[5-(PIPERIDIN-1-YL)-1,3,4-THIADIAZOL-2-YL]-1H-PYRROLE-2-CARBOXAMIDE
G015-1063 Screening compound: N-BENZYL-N-METHYL-1-[5-(PIPERIDIN-1-YL)-1,3,4-THIADIAZOL-2-YL]-1H-PYRROLE-2-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G015-1063
N-BENZYL-N-METHYL-1-[5-(PIPERIDIN-1-YL)-1,3,4-THIADIAZOL-2-YL]-1H-PYRROLE-2-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

G015-1063

Molecular Formula

C20H23N5OS (C20 H23 N5 OS)

Compound Name

N-BENZYL-N-METHYL-1-[5-(PIPERIDIN-1-YL)-1,3,4-THIADIAZOL-2-YL]-1H-PYRROLE-2-CARBOXAMIDE

IUPAC name

n/a

SMILES

CN(Cc1ccccc1)C(c1cccn1-c1nnc(N2CCCCC2)s1)=O

InChI

InChI=1S/C20H23N5OS/c1-23(15-16-9-4-2-5-10-16)18(26)17-11-8-14-25(17)20-22-21-19(27-20)24-12-6-3-7-13-24/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3

InChI Key

OSJZHHZTPCJTIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.185

Distribution Coefficient, logD

4.185

Water Solubility, LogSw

-4.10

Polar Surface Area

45.024

Acid Dissociation Constant (pKa)

22.87

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

G015-1063 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G015-1063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G015-1063?
Check Price and Availability of G015-1063, 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 G015-1063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G015-1063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G015-1063
  • 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 G015-1063 available by request