V018-6813 Screening compound: 1-{3-CYCLOPROPYL-[1,2,4]TRIAZOLO[4,3-C]QUINAZOLIN-5-YL}-4-(4-METHYLBENZOYL)-1,4-DIAZEPANE

V018-6813 Screening compound: 1-{3-CYCLOPROPYL-[1,2,4]TRIAZOLO[4,3-C]QUINAZOLIN-5-YL}-4-(4-METHYLBENZOYL)-1,4-DIAZEPANE
V018-6813 Screening compound: 1-{3-CYCLOPROPYL-[1,2,4]TRIAZOLO[4,3-C]QUINAZOLIN-5-YL}-4-(4-METHYLBENZOYL)-1,4-DIAZEPANE alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-6813
1-{3-CYCLOPROPYL-[1,2,4]TRIAZOLO[4,3-C]QUINAZOLIN-5-YL}-4-(4-METHYLBENZOYL)-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

V018-6813

Molecular Formula

C25H26N6O (C25 H26 N6 O)

Compound Name

1-{3-CYCLOPROPYL-[1,2,4]TRIAZOLO[4,3-C]QUINAZOLIN-5-YL}-4-(4-METHYLBENZOYL)-1,4-DIAZEPANE

IUPAC name

n/a

SMILES

Cc(cc1)ccc1C(N(CCC1)CCN1c1nc(cccc2)c2c2nnc(C3CC3)n12)=O

InChI

InChI=1S/C25H26N6O/c1-17-7-9-19(10-8-17)24(32)29-13-4-14-30(16-15-29)25-26-21-6-3-2-5-20(21)23-28-27-22(31(23)25)18-11-12-18/h2-3,5-10,18H,4,11-16H2,1H3

InChI Key

QUEBEATVLVESHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19902297

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

426.52

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

4.009

Distribution Coefficient, logD

4.008

Water Solubility, LogSw

-4.06

Polar Surface Area

50.303

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

4.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V018-6813 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-6813?
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What is the minimum amount of V018-6813 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-6813
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-6813
  • 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 V018-6813 available by request