4244-3660 Screening compound: 3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-2,3-dihydro-1H-indol-2-one

4244-3660 Screening compound: 3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-2,3-dihydro-1H-indol-2-one
4244-3660 Screening compound: 3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4244-3660
3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-2,3-dihydro-1H-indol-2-one

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

4244-3660

Molecular Formula

C17H14N2O5 (C17 H14 N2 O5)

Compound Name

3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

3-hydroxy-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-23-dihydro-1H-indol-2-one

SMILES

CN(C(C1(CC(c2cccc([N+]([O-])=O)c2)=O)O)=O)c2c1cccc2

InChI

InChI=1S/C17H14N2O5/c1-18-14-8-3-2-7-13(14)17(22,16(18)21)10-15(20)11-5-4-6-12(9-11)19(23)24/h2-9,22H,10H2,1H3/t17-/m0/s1

InChI Key

FNHJISBGJCAHMH-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD02919661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.768

Distribution Coefficient, logD

1.768

Water Solubility, LogSw

-2.46

Polar Surface Area

77.462

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.60

4244-3660 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4244-3660 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4244-3660?
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What is the minimum amount of 4244-3660 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4244-3660
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4244-3660
  • 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 4244-3660 available by request