4480-1011 Screening compound: 3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6-tetrone

4480-1011 Screening compound: 3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6-tetrone
4480-1011 Screening compound: 3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6-tetrone alternative view

Chemical Structure Depiction of ChemDiv screening compound 4480-1011
3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6-tetrone

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

4480-1011

Molecular Formula

C27H17Cl2NO5 (C27 H17 Cl2 NO5)

Compound Name

3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1',3,3',3a,4,5,6,6a-octahydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6-tetrone

IUPAC name

3-(3-chloro-2-methylphenyl)-5-(4-chlorophenyl)-1'33'3a4566a-octahydrospiro[furo[34-c]pyrrole-12'-indene]-1'3'46-tetrone

SMILES

Cc(c(C(C(C1C(N2c(cc3)ccc3Cl)=O)C2=O)OC1(C(c1c2cccc1)=O)C2=O)ccc1)c1Cl

InChI

InChI=1S/C27H17Cl2NO5/c1-13-16(7-4-8-19(13)29)22-20-21(26(34)30(25(20)33)15-11-9-14(28)10-12-15)27(35-22)23(31)17-5-2-3-6-18(17)24(27)32/h2-12,20-22H,1H3

InChI Key

QHLBGHUSIMRSAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01560750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.658

Distribution Coefficient, logD

4.658

Water Solubility, LogSw

-4.88

Polar Surface Area

63.735

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

-6.60

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

18.50

4480-1011 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4480-1011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4480-1011?
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What is the minimum amount of 4480-1011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4480-1011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4480-1011
  • 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 4480-1011 available by request