D487-0476 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(3-ethoxypropyl)-2,3-dihydro-1H-pyrrol-3-one

D487-0476 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(3-ethoxypropyl)-2,3-dihydro-1H-pyrrol-3-one
D487-0476 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(3-ethoxypropyl)-2,3-dihydro-1H-pyrrol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D487-0476
5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(3-ethoxypropyl)-2,3-dihydro-1H-pyrrol-3-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

D487-0476

Molecular Formula

C16H20N4O2 (C16 H20 N4 O2)

Compound Name

5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-(3-ethoxypropyl)-2,3-dihydro-1H-pyrrol-3-one

IUPAC name

5-amino-4-(1H-13-benzodiazol-2-yl)-1-(3-ethoxypropyl)-23-dihydro-1H-pyrrol-3-one

SMILES

CCOCCCN(CC1=O)C(N)=C1c1nc(cccc2)c2[nH]1

InChI

InChI=1S/C16H20N4O2/c1-2-22-9-5-8-20-10-13(21)14(15(20)17)16-18-11-6-3-4-7-12(11)19-16/h3-4,6-7H,2,5,8-10,17H2,1H3,(H,18,19)

InChI Key

PXFGNIVQGRKJIZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07324835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.429

Distribution Coefficient, logD

1.429

Water Solubility, LogSw

-2.17

Polar Surface Area

64.663

Acid Dissociation Constant (pKa)

11.59

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with D487-0476 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D487-0476?
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What is the minimum amount of D487-0476 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D487-0476
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D487-0476
  • 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 D487-0476 available by request