F856-0120 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-1,2,3-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide

F856-0120 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-1,2,3-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide
F856-0120 Screening compound: N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-1,2,3-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F856-0120
N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-1,2,3-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide

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

F856-0120

Molecular Formula

C24H31N5O4S (C24 H31 N5 O4 S)

Compound Name

N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-1,2,3-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide

IUPAC name

N-[(2-ethoxyphenyl)methyl]-1-[(1-propyl-1H-123-benzotriazol-5-yl)sulfonyl]piperidine-3-carboxamide

SMILES

CCCn1nnc2c1ccc(S(N(CCC1)CC1C(NCc(cccc1)c1OCC)=O)(=O)=O)c2

InChI

InChI=1S/C24H31N5O4S/c1-3-13-29-22-12-11-20(15-21(22)26-27-29)34(31,32)28-14-7-9-19(17-28)24(30)25-16-18-8-5-6-10-23(18)33-4-2/h5-6,8,10-12,15,19H,3-4,7,9,13-14,16-17H2,1-2H3,(H,25,30)/t19-/m0/s1

InChI Key

XHPVOLUFKCVYCN-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27200061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.888

Distribution Coefficient, logD

2.888

Water Solubility, LogSw

-3.37

Polar Surface Area

89.182

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

F856-0120 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F856-0120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F856-0120?
Check Price and Availability of F856-0120, 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 F856-0120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F856-0120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F856-0120
  • 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 F856-0120 available by request