3909-7993 Screening compound: N-(4-bromo-3-methylphenyl)-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

3909-7993 Screening compound: N-(4-bromo-3-methylphenyl)-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine
3909-7993 Screening compound: N-(4-bromo-3-methylphenyl)-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-7993
N-(4-bromo-3-methylphenyl)-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

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

3909-7993

Molecular Formula

C17H16BrN3S (C17 H16 BrN3 S)

Compound Name

N-(4-bromo-3-methylphenyl)-N-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

IUPAC name

N-(4-bromo-3-methylphenyl)-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraen-3-amine

SMILES

Cc(cc(cc1)Nc2ncnc3c2c(CCCC2)c2s3)c1Br

InChI

InChI=1S/C17H16BrN3S/c1-10-8-11(6-7-13(10)18)21-16-15-12-4-2-3-5-14(12)22-17(15)20-9-19-16/h6-9H,2-5H2,1H3,(H,19,20,21)

InChI Key

UHECKPDKWPRQBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04529287

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.847

Distribution Coefficient, logD

5.846

Water Solubility, LogSw

-5.88

Polar Surface Area

30.626

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

3909-7993 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 3909-7993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-7993?
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What is the minimum amount of 3909-7993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-7993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-7993
  • 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 3909-7993 available by request