G015-0667 Screening compound: N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

G015-0667 Screening compound: N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
G015-0667 Screening compound: N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G015-0667
N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-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

G015-0667

Molecular Formula

C17H27N7OS (C17 H27 N7 OS)

Compound Name

N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

IUPAC name

N-[2-(dimethylamino)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-134-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

SMILES

CCN(CC1)CCN1c1nnc(-n2c(C(NCCN(C)C)=O)ccc2)s1

InChI

InChI=1S/C17H27N7OS/c1-4-22-10-12-23(13-11-22)16-19-20-17(26-16)24-8-5-6-14(24)15(25)18-7-9-21(2)3/h5-6,8H,4,7,9-13H2,1-3H3,(H,18,25)

InChI Key

XYIVJZVORLRMQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.429

Distribution Coefficient, logD

0.291

Water Solubility, LogSw

-2.29

Polar Surface Area

60.802

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

G015-0667 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 G015-0667 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G015-0667?
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What is the minimum amount of G015-0667 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G015-0667
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G015-0667
  • 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 G015-0667 available by request