M785-1532 Screening compound: 2-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N~1~-isobutylacetamide

M785-1532 Screening compound: 2-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N~1~-isobutylacetamide
M785-1532 Screening compound: 2-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N~1~-isobutylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M785-1532
2-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N~1~-isobutylacetamide

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

M785-1532

Molecular Formula

C18H20N4O5 (C18 H20 N4 O5)

Compound Name

2-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydro[1]benzofuro[3,2-d]pyrimidin-3(2H)-yl]-N~1~-isobutylacetamide

IUPAC name

2-[3-(carbamoylmethyl)-46-dioxo-8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)1012-tetraen-5-yl]-N-(2-methylpropyl)acetamide

SMILES

CC(C)CNC(CN(C(c(oc1c2cccc1)c2N1CC(N)=O)=O)C1=O)=O

InChI

InChI=1S/C18H20N4O5/c1-10(2)7-20-14(24)9-22-17(25)16-15(21(18(22)26)8-13(19)23)11-5-3-4-6-12(11)27-16/h3-6,10H,7-9H2,1-2H3,(H2,19,23)(H,20,24)

InChI Key

VUCSHZFJXRQUQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27554048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.023

Distribution Coefficient, logD

1.023

Water Solubility, LogSw

-2.22

Polar Surface Area

98.974

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M785-1532 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with M785-1532 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M785-1532?
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What is the minimum amount of M785-1532 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M785-1532
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M785-1532
  • 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 M785-1532 available by request