1165-0412 Screening compound: 4-[(2,6-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-2,6-diphenylpyridine

1165-0412 Screening compound: 4-[(2,6-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-2,6-diphenylpyridine
1165-0412 Screening compound: 4-[(2,6-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-2,6-diphenylpyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1165-0412
4-[(2,6-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-2,6-diphenylpyridine

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

1165-0412

Molecular Formula

C41H29NS (C41 H29 NS)

Compound Name

4-[(2,6-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-2,6-diphenylpyridine

IUPAC name

4-[(26-diphenyl-4H-thiopyran-4-ylidene)(phenyl)methyl]-26-diphenylpyridine

SMILES

c(cc1)ccc1C(c1cc(-c2ccccc2)nc(-c2ccccc2)c1)=C1C=C(c2ccccc2)SC(c2ccccc2)=C1

InChI

InChI=1S/C41H29NS/c1-6-16-30(17-7-1)37-26-35(27-38(42-37)31-18-8-2-9-19-31)41(34-24-14-5-15-25-34)36-28-39(32-20-10-3-11-21-32)43-40(29-36)33-22-12-4-13-23-33/h1-29H

InChI Key

GGDIJUVWQZHJBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01326582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

567.75

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

11.653

Distribution Coefficient, logD

11.653

Water Solubility, LogSw

-6.54

Polar Surface Area

7.417

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1165-0412 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1165-0412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1165-0412?
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What is the minimum amount of 1165-0412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1165-0412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1165-0412
  • 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 1165-0412 available by request