C660-1551 Screening compound: N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide

C660-1551 Screening compound: N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide
C660-1551 Screening compound: N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-1551
N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide

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

C660-1551

Molecular Formula

C13H16N4OS (C13 H16 N4 OS)

Compound Name

N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide

IUPAC name

N-(carbamothioylamino)-2-(1-ethyl-1H-indol-3-yl)acetamide

SMILES

CCn1c(cccc2)c2c(CC(NNC(N)=S)=O)c1

InChI

InChI=1S/C13H16N4OS/c1-2-17-8-9(7-12(18)15-16-13(14)19)10-5-3-4-6-11(10)17/h3-6,8H,2,7H2,1H3,(H,15,18)(H3,14,16,19)

InChI Key

WITJGEBDGAFZML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780490

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.867

Distribution Coefficient, logD

0.744

Water Solubility, LogSw

-2.20

Polar Surface Area

59.442

Acid Dissociation Constant (pKa)

7.88

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C660-1551 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C660-1551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-1551?
Check Price and Availability of C660-1551, 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 C660-1551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-1551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-1551
  • 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 C660-1551 available by request