T634-0170 Screening compound: cyclopropyl[7-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone

T634-0170 Screening compound: cyclopropyl[7-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
T634-0170 Screening compound: cyclopropyl[7-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T634-0170
cyclopropyl[7-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone

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

T634-0170

Molecular Formula

C18H24N2O2 (C18 H24 N2 O2)

Compound Name

cyclopropyl[7-(1-pyrrolidinylmethyl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone

IUPAC name

4-cyclopropanecarbonyl-7-[(pyrrolidin-1-yl)methyl]-2345-tetrahydro-14-benzoxazepine

SMILES

O=C(C1CC1)N1Cc(cc(CN2CCCC2)cc2)c2OCC1

InChI

InChI=1S/C18H24N2O2/c21-18(15-4-5-15)20-9-10-22-17-6-3-14(11-16(17)13-20)12-19-7-1-2-8-19/h3,6,11,15H,1-2,4-5,7-10,12-13H2

InChI Key

AFJXZYMQZWSTHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30463432

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.403

Distribution Coefficient, logD

0.341

Water Solubility, LogSw

-2.70

Polar Surface Area

29.453

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.11

T634-0170 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with T634-0170 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T634-0170?
Check Price and Availability of T634-0170, 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 T634-0170 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T634-0170
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T634-0170
  • 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 T634-0170 available by request