M758-2061 Screening compound: N-(CYCLOPROPYLMETHYL)-1-(4-FLUORO-3-METHYLBENZENESULFONYL)-N-[(PYRIDIN-4-YL)METHYL]AZETIDIN-3-AMINE

M758-2061 Screening compound: N-(CYCLOPROPYLMETHYL)-1-(4-FLUORO-3-METHYLBENZENESULFONYL)-N-[(PYRIDIN-4-YL)METHYL]AZETIDIN-3-AMINE
M758-2061 Screening compound: N-(CYCLOPROPYLMETHYL)-1-(4-FLUORO-3-METHYLBENZENESULFONYL)-N-[(PYRIDIN-4-YL)METHYL]AZETIDIN-3-AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound M758-2061
N-(CYCLOPROPYLMETHYL)-1-(4-FLUORO-3-METHYLBENZENESULFONYL)-N-[(PYRIDIN-4-YL)METHYL]AZETIDIN-3-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

M758-2061

Molecular Formula

C20H24FN3O2S (C20 H24 FN3 O2 S)

Compound Name

N-(CYCLOPROPYLMETHYL)-1-(4-FLUORO-3-METHYLBENZENESULFONYL)-N-[(PYRIDIN-4-YL)METHYL]AZETIDIN-3-AMINE

IUPAC name

N-(cyclopropylmethyl)-1-(4-fluoro-3-methylbenzenesulfonyl)-N-[(pyridin-4-yl)methyl]azetidin-3-amine

SMILES

Cc(cc(cc1)S(N(C2)CC2N(CC2CC2)Cc2ccncc2)(=O)=O)c1F

InChI

InChI=1S/C20H24FN3O2S/c1-15-10-19(4-5-20(15)21)27(25,26)24-13-18(14-24)23(11-16-2-3-16)12-17-6-8-22-9-7-17/h4-10,16,18H,2-3,11-14H2,1H3

InChI Key

UTTNRBGUIPEUPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31956332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.737

Distribution Coefficient, logD

1.913

Water Solubility, LogSw

-2.84

Polar Surface Area

44.483

Acid Dissociation Constant (pKa)

25.63

Base Dissociation Constant (pKb)

8.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

M758-2061 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M758-2061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M758-2061?
Check Price and Availability of M758-2061, 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 M758-2061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M758-2061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M758-2061
  • 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 M758-2061 available by request