3909-7945 Screening compound: 4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline

3909-7945 Screening compound: 4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline
3909-7945 Screening compound: 4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-7945
4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline

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

3909-7945

Molecular Formula

C21H23N3 (C21 H23 N3)

Compound Name

4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline

IUPAC name

4-(azepan-1-yl)-2-(3-methylphenyl)quinazoline

SMILES

Cc1cccc(-c2nc3ccccc3c(N3CCCCCC3)n2)c1

InChI

InChI=1S/C21H23N3/c1-16-9-8-10-17(15-16)20-22-19-12-5-4-11-18(19)21(23-20)24-13-6-2-3-7-14-24/h4-5,8-12,15H,2-3,6-7,13-14H2,1H3

InChI Key

QJSLAHHBSQSQBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08052400

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.43

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.497

Distribution Coefficient, logD

5.599

Water Solubility, LogSw

-6.08

Polar Surface Area

21.969

Acid Dissociation Constant (pKa)

22.80

Base Dissociation Constant (pKb)

8.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

3909-7945 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Antibacterial Compounds Library (13827 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 3909-7945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-7945?
Check Price and Availability of 3909-7945, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3909-7945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-7945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-7945
  • 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 3909-7945 available by request