V016-7508 Screening compound: [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](2-furyl)methanone

V016-7508 Screening compound: [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](2-furyl)methanone
V016-7508 Screening compound: [4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](2-furyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-7508
[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](2-furyl)methanone

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

V016-7508

Molecular Formula

C25H28N6O2 (C25 H28 N6 O2)

Compound Name

[4-(3-cyclohexyl[1,2,4]triazolo[4,3-c]quinazolin-5-yl)-1,4-diazepan-1-yl](2-furyl)methanone

IUPAC name

1-{3-cyclohexyl-[124]triazolo[43-c]quinazolin-5-yl}-4-(furan-2-carbonyl)-14-diazepane

SMILES

O=C(c1ccco1)N(CCC1)CCN1c1nc(cccc2)c2c2nnc(C3CCCCC3)n12

InChI

InChI=1S/C25H28N6O2/c32-24(21-12-6-17-33-21)29-13-7-14-30(16-15-29)25-26-20-11-5-4-10-19(20)23-28-27-22(31(23)25)18-8-2-1-3-9-18/h4-6,10-12,17-18H,1-3,7-9,13-16H2

InChI Key

NBVLPGPEMANGTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19902226

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

444.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.205

Distribution Coefficient, logD

4.204

Water Solubility, LogSw

-4.21

Polar Surface Area

58.551

Acid Dissociation Constant (pKa)

21.10

Base Dissociation Constant (pKb)

9.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V016-7508 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-7508?
Check Price and Availability of V016-7508, 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 V016-7508 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-7508
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-7508
  • 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 V016-7508 available by request