C087-1380 Screening compound: 3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea

C087-1380 Screening compound: 3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea
C087-1380 Screening compound: 3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C087-1380
3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea

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

C087-1380

Molecular Formula

C20H26ClN3S2 (C20 H26 ClN3 S2)

Compound Name

3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea

IUPAC name

3-(2-chlorophenyl)-1-[3-(piperidin-1-yl)propyl]-1-[(thiophen-2-yl)methyl]thiourea

SMILES

S=C(Nc(cccc1)c1Cl)N(CCCN1CCCCC1)Cc1cccs1

InChI

InChI=1S/C20H26ClN3S2/c21-18-9-2-3-10-19(18)22-20(25)24(16-17-8-6-15-26-17)14-7-13-23-11-4-1-5-12-23/h2-3,6,8-10,15H,1,4-5,7,11-14,16H2,(H,22,25)

InChI Key

YTBLSJJCZNSNKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14718418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.03

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.058

Distribution Coefficient, logD

2.995

Water Solubility, LogSw

-5.29

Polar Surface Area

14.709

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with C087-1380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C087-1380?
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What is the minimum amount of C087-1380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C087-1380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C087-1380
  • 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 C087-1380 available by request