G404-0840 Screening compound: 1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine

G404-0840 Screening compound: 1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine
G404-0840 Screening compound: 1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G404-0840
1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine

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

G404-0840

Molecular Formula

C21H29N5O4S (C21 H29 N5 O4 S)

Compound Name

1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine

IUPAC name

1-(2-methoxyphenyl)-4-{1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carbonyl}piperazine

SMILES

Cn1cnc(S(N(CCC2)CC2C(N(CC2)CCN2c(cccc2)c2OC)=O)(=O)=O)c1

InChI

InChI=1S/C21H29N5O4S/c1-23-15-20(22-16-23)31(28,29)26-9-5-6-17(14-26)21(27)25-12-10-24(11-13-25)18-7-3-4-8-19(18)30-2/h3-4,7-8,15-17H,5-6,9-14H2,1-2H3/t17-/m0/s1

InChI Key

YXMRCKPFOQPRCE-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27138760

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.962

Distribution Coefficient, logD

0.962

Water Solubility, LogSw

-2.18

Polar Surface Area

71.532

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

4.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.40

G404-0840 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G404-0840 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G404-0840?
Check Price and Availability of G404-0840, 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 G404-0840 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G404-0840
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G404-0840
  • 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 G404-0840 available by request