D340-2596 Screening compound: N4-(2,3-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-4,5-dicarboxamide

D340-2596 Screening compound: N4-(2,3-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-4,5-dicarboxamide
D340-2596 Screening compound: N4-(2,3-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-4,5-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D340-2596
N4-(2,3-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-4,5-dicarboxamide

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

D340-2596

Molecular Formula

C19H24N4O2 (C19 H24 N4 O2)

Compound Name

N4-(2,3-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-4,5-dicarboxamide

IUPAC name

N4-(23-dihydro-1H-inden-1-yl)-N5-(3-methylbutyl)-1H-imidazole-45-dicarboxamide

SMILES

CC(C)CCNC(c1c(C(NC(CC2)c3c2cccc3)=O)nc[nH]1)=O

InChI

InChI=1S/C19H24N4O2/c1-12(2)9-10-20-18(24)16-17(22-11-21-16)19(25)23-15-8-7-13-5-3-4-6-14(13)15/h3-6,11-12,15H,7-10H2,1-2H3,(H,20,24)(H,21,22)(H,23,25)/t15-/m0/s1

InChI Key

KRZCZYFZGWQZIX-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14820656

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.496

Distribution Coefficient, logD

2.490

Water Solubility, LogSw

-2.69

Polar Surface Area

71.757

Acid Dissociation Constant (pKa)

7.22

Base Dissociation Constant (pKb)

0.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

D340-2596 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D340-2596 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D340-2596?
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What is the minimum amount of D340-2596 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D340-2596
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D340-2596
  • 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 D340-2596 available by request