T634-0362 Screening compound: diethyl({[4-(6-methylpyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl})amine

T634-0362 Screening compound: diethyl({[4-(6-methylpyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl})amine
T634-0362 Screening compound: diethyl({[4-(6-methylpyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl})amine alternative view

Chemical Structure Depiction of ChemDiv screening compound T634-0362
diethyl({[4-(6-methylpyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl})amine

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

T634-0362

Molecular Formula

C21H27N3O2 (C21 H27 N3 O2)

Compound Name

diethyl({[4-(6-methylpyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl})amine

IUPAC name

diethyl({[4-(6-methylpyridine-3-carbonyl)-2345-tetrahydro-14-benzoxazepin-7-yl]methyl})amine

SMILES

CCN(CC)Cc(cc1)cc(C2)c1OCCN2C(c1cnc(C)cc1)=O

InChI

InChI=1S/C21H27N3O2/c1-4-23(5-2)14-17-7-9-20-19(12-17)15-24(10-11-26-20)21(25)18-8-6-16(3)22-13-18/h6-9,12-13H,4-5,10-11,14-15H2,1-3H3

InChI Key

VJWKBKOOAZNYQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32000472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.562

Distribution Coefficient, logD

0.808

Water Solubility, LogSw

-2.47

Polar Surface Area

37.208

Acid Dissociation Constant (pKa)

26.85

Base Dissociation Constant (pKb)

9.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

T634-0362 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS BBB Library (22607 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Hemic and lymphatic
  • Nervous system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T634-0362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T634-0362?
Check Price and Availability of T634-0362, 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 T634-0362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T634-0362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T634-0362
  • 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 T634-0362 available by request