L525-0194 Screening compound: 3-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea

L525-0194 Screening compound: 3-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea
L525-0194 Screening compound: 3-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L525-0194
3-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea

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

L525-0194

Molecular Formula

C18H21N3O3S2 (C18 H21 N3 O3 S2)

Compound Name

3-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea

IUPAC name

3-[1-(ethanesulfonyl)-23-dihydro-1H-indol-6-yl]-1-[3-(methylsulfanyl)phenyl]urea

SMILES

CCS(N(CC1)c2c1ccc(NC(Nc1cc(SC)ccc1)=O)c2)(=O)=O

InChI

InChI=1S/C18H21N3O3S2/c1-3-26(23,24)21-10-9-13-7-8-15(12-17(13)21)20-18(22)19-14-5-4-6-16(11-14)25-2/h4-8,11-12H,3,9-10H2,1-2H3,(H2,19,20,22)

InChI Key

YDJXTUIFGGTHDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15129640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.783

Distribution Coefficient, logD

3.783

Water Solubility, LogSw

-3.89

Polar Surface Area

64.226

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

-0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

L525-0194 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L525-0194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L525-0194?
Check Price and Availability of L525-0194, 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 L525-0194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L525-0194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L525-0194
  • 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 L525-0194 available by request