C074-0086 Screening compound: 4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

C074-0086 Screening compound: 4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
C074-0086 Screening compound: 4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C074-0086
4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

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

C074-0086

Molecular Formula

C21H19N3OS (C21 H19 N3 OS)

Compound Name

4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

IUPAC name

4-(ethylsulfanyl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[23-d]pyrimidine

SMILES

CCSc1ncnc2c1c(-c1ccccc1)cn2-c(cc1)ccc1OC

InChI

InChI=1S/C21H19N3OS/c1-3-26-21-19-18(15-7-5-4-6-8-15)13-24(20(19)22-14-23-21)16-9-11-17(25-2)12-10-16/h4-14H,3H2,1-2H3

InChI Key

YUWFRNSTUIWDCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04453679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.253

Distribution Coefficient, logD

5.253

Water Solubility, LogSw

-5.25

Polar Surface Area

30.502

Acid Dissociation Constant (pKa)

25.00

Base Dissociation Constant (pKb)

4.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with C074-0086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C074-0086?
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What is the minimum amount of C074-0086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C074-0086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C074-0086
  • 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 C074-0086 available by request