4358-4615 Screening compound: N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-amine

4358-4615 Screening compound: N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-amine
4358-4615 Screening compound: N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4358-4615
N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-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

4358-4615

Molecular Formula

C18H18N4O3 (C18 H18 N4 O3)

Compound Name

N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-amine

IUPAC name

N-(3-methoxypropyl)-2-(4-nitrophenyl)quinazolin-4-amine

SMILES

COCCCNc1nc(-c(cc2)ccc2[N+]([O-])=O)nc2ccccc12

InChI

InChI=1S/C18H18N4O3/c1-25-12-4-11-19-18-15-5-2-3-6-16(15)20-17(21-18)13-7-9-14(10-8-13)22(23)24/h2-3,5-10H,4,11-12H2,1H3,(H,19,20,21)

InChI Key

RBYBEEPKZVHFPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02369142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.631

Distribution Coefficient, logD

4.365

Water Solubility, LogSw

-4.38

Polar Surface Area

70.964

Acid Dissociation Constant (pKa)

20.13

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

4358-4615 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4358-4615 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4358-4615?
Check Price and Availability of 4358-4615, 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 4358-4615 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4358-4615
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4358-4615
  • 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 4358-4615 available by request