T835-1912 Screening compound: 3-[(3-isobutyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]-N~1~-methyl-1-pyrrolidinecarboxamide

T835-1912 Screening compound: 3-[(3-isobutyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]-N~1~-methyl-1-pyrrolidinecarboxamide
T835-1912 Screening compound: 3-[(3-isobutyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]-N~1~-methyl-1-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T835-1912
3-[(3-isobutyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]-N~1~-methyl-1-pyrrolidinecarboxamide

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

T835-1912

Molecular Formula

C17H25N5O (C17 H25 N5 O)

Compound Name

3-[(3-isobutyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]-N~1~-methyl-1-pyrrolidinecarboxamide

IUPAC name

N-methyl-3-{[3-(2-methylpropyl)-3H-imidazo[45-b]pyridin-2-yl]methyl}pyrrolidine-1-carboxamide

SMILES

CC(C)Cn1c(nccc2)c2nc1CC(CC1)CN1C(NC)=O

InChI

InChI=1S/C17H25N5O/c1-12(2)10-22-15(20-14-5-4-7-19-16(14)22)9-13-6-8-21(11-13)17(23)18-3/h4-5,7,12-13H,6,8-11H2,1-3H3,(H,18,23)/t13-/m0/s1

InChI Key

KECVPANWUWFIAK-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27624191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.555

Distribution Coefficient, logD

2.555

Water Solubility, LogSw

-2.59

Polar Surface Area

48.563

Acid Dissociation Constant (pKa)

16.65

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.82

T835-1912 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Soluble Diversity Library (15920 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T835-1912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T835-1912?
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What is the minimum amount of T835-1912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T835-1912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T835-1912
  • 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 T835-1912 available by request