V024-1807 Screening compound: 1-{3-cyclohexyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-fluorobenzoyl)-1,4-diazepane

V024-1807 Screening compound: 1-{3-cyclohexyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-fluorobenzoyl)-1,4-diazepane
V024-1807 Screening compound: 1-{3-cyclohexyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-fluorobenzoyl)-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-1807
1-{3-cyclohexyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-fluorobenzoyl)-1,4-diazepane

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

V024-1807

Molecular Formula

C27H29FN6O (C27 H29 FN6 O)

Compound Name

1-{3-cyclohexyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-fluorobenzoyl)-1,4-diazepane

IUPAC name

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

SMILES

O=C(c(cc1)ccc1F)N(CCC1)CCN1c1nc(cccc2)c2c2nnc(C3CCCCC3)n12

InChI

InChI=1S/C27H29FN6O/c28-21-13-11-20(12-14-21)26(35)32-15-6-16-33(18-17-32)27-29-23-10-5-4-9-22(23)25-31-30-24(34(25)27)19-7-2-1-3-8-19/h4-5,9-14,19H,1-3,6-8,15-18H2

InChI Key

PGISUVRNFYCOER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19924027

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.817

Distribution Coefficient, logD

4.817

Water Solubility, LogSw

-5.01

Polar Surface Area

49.972

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V024-1807 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V024-1807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-1807?
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What is the minimum amount of V024-1807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-1807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-1807
  • 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 V024-1807 available by request