C198-0120 Screening compound: 1-benzyl-1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea

C198-0120 Screening compound: 1-benzyl-1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea
C198-0120 Screening compound: 1-benzyl-1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C198-0120
1-benzyl-1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea

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

C198-0120

Molecular Formula

C22H27N3S (C22 H27 N3 S)

Compound Name

1-benzyl-1-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea

IUPAC name

1-benzyl-1-[2-(25-dimethyl-1H-indol-3-yl)ethyl]-3-ethylthiourea

SMILES

CCNC(N(CCc1c(C)[nH]c2c1cc(C)cc2)Cc1ccccc1)=S

InChI

InChI=1S/C22H27N3S/c1-4-23-22(26)25(15-18-8-6-5-7-9-18)13-12-19-17(3)24-21-11-10-16(2)14-20(19)21/h5-11,14,24H,4,12-13,15H2,1-3H3,(H,23,26)

InChI Key

WKPOJMOKCFEHQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04460416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.54

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.996

Distribution Coefficient, logD

4.996

Water Solubility, LogSw

-4.74

Polar Surface Area

21.552

Acid Dissociation Constant (pKa)

17.44

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with C198-0120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C198-0120?
Check Price and Availability of C198-0120, 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 C198-0120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C198-0120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C198-0120
  • 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 C198-0120 available by request