T634-0339 Screening compound: [(4-cyclopropanecarbonyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)methyl]diethylamine

T634-0339 Screening compound: [(4-cyclopropanecarbonyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)methyl]diethylamine
T634-0339 Screening compound: [(4-cyclopropanecarbonyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)methyl]diethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound T634-0339
[(4-cyclopropanecarbonyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)methyl]diethylamine

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

T634-0339

Molecular Formula

C18H26N2O2 (C18 H26 N2 O2)

Compound Name

[(4-cyclopropanecarbonyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)methyl]diethylamine

IUPAC name

[(4-cyclopropanecarbonyl-2345-tetrahydro-14-benzoxazepin-7-yl)methyl]diethylamine

SMILES

CCN(CC)Cc(cc1)cc(C2)c1OCCN2C(C1CC1)=O

InChI

InChI=1S/C18H26N2O2/c1-3-19(4-2)12-14-5-8-17-16(11-14)13-20(9-10-22-17)18(21)15-6-7-15/h5,8,11,15H,3-4,6-7,9-10,12-13H2,1-2H3

InChI Key

JNNVJFOXZNGNBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32000469

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.670

Distribution Coefficient, logD

0.916

Water Solubility, LogSw

-2.66

Polar Surface Area

28.787

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

9.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.11

T634-0339 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T634-0339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T634-0339?
Check Price and Availability of T634-0339, 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 T634-0339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T634-0339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T634-0339
  • 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 T634-0339 available by request