V022-6982 Screening compound: 1-{8-chloro-3-methyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine

V022-6982 Screening compound: 1-{8-chloro-3-methyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine
V022-6982 Screening compound: 1-{8-chloro-3-methyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6982
1-{8-chloro-3-methyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine

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

V022-6982

Molecular Formula

C22H20ClN7O3 (C22 H20 ClN7 O3)

Compound Name

1-{8-chloro-3-methyl-[1,2,4]triazolo[4,3-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine

IUPAC name

1-{8-chloro-3-methyl-[124]triazolo[43-c]quinazolin-5-yl}-4-(4-methyl-3-nitrobenzoyl)piperazine

SMILES

Cc1nnc2n1c(N(CC1)CCN1C(c1cc([N+]([O-])=O)c(C)cc1)=O)nc1c2ccc(Cl)c1

InChI

InChI=1S/C22H20ClN7O3/c1-13-3-4-15(11-19(13)30(32)33)21(31)27-7-9-28(10-8-27)22-24-18-12-16(23)5-6-17(18)20-26-25-14(2)29(20)22/h3-6,11-12H,7-10H2,1-2H3

InChI Key

NIWVLDDDTLCMCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19923109

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

465.9

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.287

Water Solubility, LogSw

-4.02

Polar Surface Area

83.578

Acid Dissociation Constant (pKa)

20.97

Base Dissociation Constant (pKb)

7.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with V022-6982 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6982?
Check Price and Availability of V022-6982, 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 V022-6982 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6982
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6982
  • 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 V022-6982 available by request