D487-0485 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-propyl-2,3-dihydro-1H-pyrrol-3-one

D487-0485 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-propyl-2,3-dihydro-1H-pyrrol-3-one
D487-0485 Screening compound: 5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-propyl-2,3-dihydro-1H-pyrrol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D487-0485
5-amino-4-(1H-1,3-benzodiazol-2-yl)-1-propyl-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

D487-0485

Molecular Formula

C14H16N4O (C14 H16 N4 O)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C14H16N4O/c1-2-7-18-8-11(19)12(13(18)15)14-16-9-5-3-4-6-10(9)17-14/h3-6H,2,7-8,15H2,1H3,(H,16,17)

InChI Key

LBWDPIDIXMBZKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06650757

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.663

Distribution Coefficient, logD

1.663

Water Solubility, LogSw

-2.19

Polar Surface Area

56.686

Acid Dissociation Constant (pKa)

11.59

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with D487-0485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D487-0485?
Check Price and Availability of D487-0485, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D487-0485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D487-0485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D487-0485
  • 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 D487-0485 available by request