G307-1771 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one

G307-1771 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one
G307-1771 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G307-1771
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one

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

G307-1771

Molecular Formula

C21H27N5O6S (C21 H27 N5 O6 S)

Compound Name

1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one

IUPAC name

1-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-[4-(morpholine-4-sulfonyl)-1H-imidazol-1-yl]ethan-1-one

SMILES

O=C(Cn1cnc(S(N2CCOCC2)(=O)=O)c1)N1CCN(Cc(cc2)cc3c2OCO3)CC1

InChI

InChI=1S/C21H27N5O6S/c27-21(14-24-13-20(22-15-24)33(28,29)26-7-9-30-10-8-26)25-5-3-23(4-6-25)12-17-1-2-18-19(11-17)32-16-31-18/h1-2,11,13,15H,3-10,12,14,16H2

InChI Key

FUKREBRWZLRGIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14996712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.084

Distribution Coefficient, logD

-0.275

Water Solubility, LogSw

-2.11

Polar Surface Area

88.744

Acid Dissociation Constant (pKa)

19.51

Base Dissociation Constant (pKb)

7.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

G307-1771 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G307-1771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G307-1771?
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What is the minimum amount of G307-1771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G307-1771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G307-1771
  • 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 G307-1771 available by request