C276-0282 Screening compound: 2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

C276-0282 Screening compound: 2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
C276-0282 Screening compound: 2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0282
2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

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

C276-0282

Molecular Formula

C21H25NO4S (C21 H25 NO4 S)

Compound Name

2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

IUPAC name

2-(ethylsulfanyl)ethyl 6-(4-methoxyphenyl)-3-methyl-4-oxo-4567-tetrahydro-1H-indole-2-carboxylate

SMILES

CCSCCOC(c1c(C)c(C(CC(C2)c(cc3)ccc3OC)=O)c2[nH]1)=O

InChI

InChI=1S/C21H25NO4S/c1-4-27-10-9-26-21(24)20-13(2)19-17(22-20)11-15(12-18(19)23)14-5-7-16(25-3)8-6-14/h5-8,15,22H,4,9-12H2,1-3H3/t15-/m1/s1

InChI Key

FSQPCICBPWTIAB-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD06651902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.017

Distribution Coefficient, logD

4.017

Water Solubility, LogSw

-4.33

Polar Surface Area

53.632

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

-4.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with C276-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0282?
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What is the minimum amount of C276-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0282
  • 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 C276-0282 available by request