D314-0137 Screening compound: 1-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-ethylpiperazine

D314-0137 Screening compound: 1-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-ethylpiperazine
D314-0137 Screening compound: 1-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-ethylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D314-0137
1-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-ethylpiperazine

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

D314-0137

Molecular Formula

C20H31N5OS (C20 H31 N5 OS)

Compound Name

1-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]-4-ethylpiperazine

IUPAC name

1-[2-(4-butyl-35-dimethyl-1H-pyrazol-1-yl)-4-methyl-13-thiazole-5-carbonyl]-4-ethylpiperazine

SMILES

CCCCc1c(C)n(-c2nc(C)c(C(N3CCN(CC)CC3)=O)s2)nc1C

InChI

InChI=1S/C20H31N5OS/c1-6-8-9-17-14(3)22-25(16(17)5)20-21-15(4)18(27-20)19(26)24-12-10-23(7-2)11-13-24/h6-13H2,1-5H3

InChI Key

LIUNPZUHZNBFEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14818018

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

389.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.522

Distribution Coefficient, logD

3.352

Water Solubility, LogSw

-3.63

Polar Surface Area

45.239

Acid Dissociation Constant (pKa)

21.46

Base Dissociation Constant (pKb)

7.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

References: we are preparing a list of scientific research reports with D314-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D314-0137?
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What is the minimum amount of D314-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D314-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D314-0137
  • 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 D314-0137 available by request