F856-0313 Screening compound: 1-{[1-(2-methoxyethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-3-carboxamide

F856-0313 Screening compound: 1-{[1-(2-methoxyethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-3-carboxamide
F856-0313 Screening compound: 1-{[1-(2-methoxyethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F856-0313
1-{[1-(2-methoxyethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-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

F856-0313

Molecular Formula

C18H27N5O4S (C18 H27 N5 O4 S)

Compound Name

1-{[1-(2-methoxyethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-3-carboxamide

IUPAC name

1-{[1-(2-methoxyethyl)-1H-123-benzotriazol-5-yl]sulfonyl}-N-propylpiperidine-3-carboxamide

SMILES

CCCNC(C(CCC1)CN1S(c(cc1)cc2c1n(CCOC)nn2)(=O)=O)=O

InChI

InChI=1S/C18H27N5O4S/c1-3-8-19-18(24)14-5-4-9-22(13-14)28(25,26)15-6-7-17-16(12-15)20-21-23(17)10-11-27-2/h6-7,12,14H,3-5,8-11,13H2,1-2H3,(H,19,24)/t14-/m0/s1

InChI Key

HDXIJSZDQSIURP-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27200112

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.807

Distribution Coefficient, logD

0.807

Water Solubility, LogSw

-2.43

Polar Surface Area

90.428

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

1.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

References: we are preparing a list of scientific research reports with F856-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F856-0313?
Check Price and Availability of F856-0313, 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 F856-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F856-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F856-0313
  • 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 F856-0313 available by request