V015-1353 Screening compound: 1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepane

V015-1353 Screening compound: 1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepane
V015-1353 Screening compound: 1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-1353
1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-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

V015-1353

Molecular Formula

C26H27N7O3 (C26 H27 N7 O3)

Compound Name

1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-1,4-diazepane

IUPAC name

1-cyclopentanecarbonyl-4-[3-(2-nitrophenyl)-[124]triazolo[43-c]quinazolin-5-yl]-14-diazepane

SMILES

[O-][N+](c(cccc1)c1-c1nnc2n1c(N(CCC1)CCN1C(C1CCCC1)=O)nc1c2cccc1)=O

InChI

InChI=1S/C26H27N7O3/c34-25(18-8-1-2-9-18)30-14-7-15-31(17-16-30)26-27-21-12-5-3-10-19(21)23-28-29-24(32(23)26)20-11-4-6-13-22(20)33(35)36/h3-6,10-13,18H,1-2,7-9,14-17H2

InChI Key

BWOARRGNVCOMCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19923557

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.177

Distribution Coefficient, logD

4.171

Water Solubility, LogSw

-4.43

Polar Surface Area

83.419

Acid Dissociation Constant (pKa)

21.18

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

V015-1353 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V015-1353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-1353?
Check Price and Availability of V015-1353, 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 V015-1353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-1353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-1353
  • 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 V015-1353 available by request