3061-4641 Screening compound: 4,5,6,7-tetrachloro-2-[1-(3,4-dichlorophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-2,3-dihydro-1H-isoindole-1,3-dione

3061-4641 Screening compound: 4,5,6,7-tetrachloro-2-[1-(3,4-dichlorophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-2,3-dihydro-1H-isoindole-1,3-dione
3061-4641 Screening compound: 4,5,6,7-tetrachloro-2-[1-(3,4-dichlorophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3061-4641
4,5,6,7-tetrachloro-2-[1-(3,4-dichlorophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-2,3-dihydro-1H-isoindole-1,3-dione

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

3061-4641

Molecular Formula

C26H16Cl6N2O6 (C26 H16 Cl6 N2 O6)

Compound Name

4,5,6,7-tetrachloro-2-[1-(3,4-dichlorophenyl)-2-oxo-4-(3,4,5-trimethoxyphenyl)azetidin-3-yl]-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

4567-tetrachloro-2-[1-(34-dichlorophenyl)-2-oxo-4-(345-trimethoxyphenyl)azetidin-3-yl]-23-dihydro-1H-isoindole-13-dione

SMILES

COc1cc(C(C(C2=O)N(C(c(c3c(c(Cl)c4Cl)Cl)c4Cl)=O)C3=O)N2c(cc2)cc(Cl)c2Cl)cc(OC)c1OC

InChI

InChI=1S/C26H16Cl6N2O6/c1-38-13-6-9(7-14(39-2)23(13)40-3)21-22(26(37)33(21)10-4-5-11(27)12(28)8-10)34-24(35)15-16(25(34)36)18(30)20(32)19(31)17(15)29/h4-8,21-22H,1-3H3

InChI Key

UXOBXWGDZCVSBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02085985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

665.14

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.986

Distribution Coefficient, logD

5.986

Water Solubility, LogSw

-7.22

Polar Surface Area

65.833

Acid Dissociation Constant (pKa)

16.55

Base Dissociation Constant (pKb)

-3.69

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with 3061-4641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3061-4641?
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What is the minimum amount of 3061-4641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3061-4641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3061-4641
  • 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 3061-4641 available by request