8007-4038 Screening compound: {[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate

8007-4038 Screening compound: {[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate
8007-4038 Screening compound: {[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-4038
{[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate

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

8007-4038

Molecular Formula

C21H18N2O7 (C21 H18 N2 O7)

Compound Name

{[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(2,5-dioxopyrrolidin-1-yl)benzoate

IUPAC name

{[3-(methoxycarbonyl)phenyl]carbamoyl}methyl 4-(25-dioxopyrrolidin-1-yl)benzoate

SMILES

COC(c1cccc(NC(COC(c(cc2)ccc2N(C(CC2)=O)C2=O)=O)=O)c1)=O

InChI

InChI=1S/C21H18N2O7/c1-29-20(27)14-3-2-4-15(11-14)22-17(24)12-30-21(28)13-5-7-16(8-6-13)23-18(25)9-10-19(23)26/h2-8,11H,9-10,12H2,1H3,(H,22,24)

InChI Key

ITBGGTDCFUAFCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01304622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.38

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.607

Distribution Coefficient, logD

1.607

Water Solubility, LogSw

-2.21

Polar Surface Area

94.888

Acid Dissociation Constant (pKa)

12.41

Base Dissociation Constant (pKb)

-1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

8007-4038 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8007-4038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-4038?
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What is the minimum amount of 8007-4038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-4038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-4038
  • 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 8007-4038 available by request