8017-3201 Screening compound: 1-(4-fluorobenzoyl)-1-methyl-1a-[(2-oxo-2H-chromen-3-yl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one

8017-3201 Screening compound: 1-(4-fluorobenzoyl)-1-methyl-1a-[(2-oxo-2H-chromen-3-yl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
8017-3201 Screening compound: 1-(4-fluorobenzoyl)-1-methyl-1a-[(2-oxo-2H-chromen-3-yl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-3201
1-(4-fluorobenzoyl)-1-methyl-1a-[(2-oxo-2H-chromen-3-yl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-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

8017-3201

Molecular Formula

C28H17FO6 (C28 H17 FO6)

Compound Name

1-(4-fluorobenzoyl)-1-methyl-1a-[(2-oxo-2H-chromen-3-yl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one

IUPAC name

n/a

SMILES

CC(C1c(cccc2)c2O2)(C1(C(C1=Cc(cccc3)c3OC1=O)=O)C2=O)C(c(cc1)ccc1F)=O

InChI

InChI=1S/C28H17FO6/c1-27(23(30)15-10-12-17(29)13-11-15)22-18-7-3-5-9-21(18)35-26(33)28(22,27)24(31)19-14-16-6-2-4-8-20(16)34-25(19)32/h2-14,22H,1H3

InChI Key

GLZXPHLGBVQQOD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.925

Distribution Coefficient, logD

4.923

Water Solubility, LogSw

-4.85

Polar Surface Area

69.268

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with 8017-3201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-3201?
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What is the minimum amount of 8017-3201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-3201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-3201
  • 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 8017-3201 available by request