V011-1770 Screening compound: N-cyclohexyl-2-{1-ethyl-2,5-dioxo-4-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl}-3-methylbutanamide

V011-1770 Screening compound: N-cyclohexyl-2-{1-ethyl-2,5-dioxo-4-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl}-3-methylbutanamide
V011-1770 Screening compound: N-cyclohexyl-2-{1-ethyl-2,5-dioxo-4-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl}-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-1770
N-cyclohexyl-2-{1-ethyl-2,5-dioxo-4-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl}-3-methylbutanamide

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

V011-1770

Molecular Formula

C26H33F3N4O3 (C26 H33 F3 N4 O3)

Compound Name

N-cyclohexyl-2-{1-ethyl-2,5-dioxo-4-[4-(trifluoromethyl)phenyl]-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl}-3-methylbutanamide

IUPAC name

N-cyclohexyl-2-{1-ethyl-25-dioxo-4-[4-(trifluoromethyl)phenyl]-1H2H3H4H5H6H7H-pyrrolo[34-d]pyrimidin-6-yl}-3-methylbutanamide

SMILES

CCN(C(CN1C(C(C)C)C(NC2CCCCC2)=O)=C(C(c2ccc(C(F)(F)F)cc2)N2)C1=O)C2=O

InChI

InChI=1S/C26H33F3N4O3/c1-4-32-19-14-33(22(15(2)3)23(34)30-18-8-6-5-7-9-18)24(35)20(19)21(31-25(32)36)16-10-12-17(13-11-16)26(27,28)29/h10-13,15,18,21-22H,4-9,14H2,1-3H3,(H,30,34)(H,31,36)

InChI Key

LIWODUZUOJTWBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19936099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.444

Distribution Coefficient, logD

4.429

Water Solubility, LogSw

-4.15

Polar Surface Area

67.998

Acid Dissociation Constant (pKa)

8.83

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

57.70

V011-1770 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V011-1770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-1770?
Check Price and Availability of V011-1770, 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 V011-1770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-1770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-1770
  • 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 V011-1770 available by request