C795-2207 Screening compound: 1-{[1,1'-biphenyl]-4-sulfonyl}-4-{3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}piperazine

C795-2207 Screening compound: 1-{[1,1'-biphenyl]-4-sulfonyl}-4-{3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}piperazine
C795-2207 Screening compound: 1-{[1,1'-biphenyl]-4-sulfonyl}-4-{3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-2207
1-{[1,1'-biphenyl]-4-sulfonyl}-4-{3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}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

C795-2207

Molecular Formula

C30H29N5O2S (C30 H29 N5 O2 S)

Compound Name

1-{[1,1'-biphenyl]-4-sulfonyl}-4-{3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}piperazine

IUPAC name

1-{[11'-biphenyl]-4-sulfonyl}-4-{34-dimethyl-1-phenyl-1H-pyrazolo[34-b]pyridin-6-yl}piperazine

SMILES

Cc(c(c(C)c1)c2nc1N(CC1)CCN1S(c(cc1)ccc1-c1ccccc1)(=O)=O)nn2-c1ccccc1

InChI

InChI=1S/C30H29N5O2S/c1-22-21-28(31-30-29(22)23(2)32-35(30)26-11-7-4-8-12-26)33-17-19-34(20-18-33)38(36,37)27-15-13-25(14-16-27)24-9-5-3-6-10-24/h3-16,21H,17-20H2,1-2H3

InChI Key

MLWVLWMQMJMCFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.66

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.413

Distribution Coefficient, logD

6.408

Water Solubility, LogSw

-6.20

Polar Surface Area

57.797

Acid Dissociation Constant (pKa)

23.71

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C795-2207 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C795-2207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-2207?
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What is the minimum amount of C795-2207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-2207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-2207
  • 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 C795-2207 available by request