V007-6991 Screening compound: 3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(2,3-dimethylphenyl)methyl]propanamide

V007-6991 Screening compound: 3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(2,3-dimethylphenyl)methyl]propanamide
V007-6991 Screening compound: 3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(2,3-dimethylphenyl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-6991
3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(2,3-dimethylphenyl)methyl]propanamide

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

V007-6991

Molecular Formula

C32H33N3O (C32 H33 N3 O)

Compound Name

3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(2,3-dimethylphenyl)methyl]propanamide

IUPAC name

3-{1-[4-(cyanomethyl)phenyl]-5-(24-dimethylphenyl)-1H-pyrrol-2-yl}-N-[(23-dimethylphenyl)methyl]propanamide

SMILES

Cc(cc1)cc(C)c1-c1ccc(CCC(NCc2c(C)c(C)ccc2)=O)n1-c1ccc(CC#N)cc1

InChI

InChI=1S/C32H33N3O/c1-22-8-15-30(24(3)20-22)31-16-13-29(35(31)28-11-9-26(10-12-28)18-19-33)14-17-32(36)34-21-27-7-5-6-23(2)25(27)4/h5-13,15-16,20H,14,17-18,21H2,1-4H3,(H,34,36)

InChI Key

GADHDUDFUNSLFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19961861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.63

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.885

Distribution Coefficient, logD

6.885

Water Solubility, LogSw

-5.59

Polar Surface Area

43.087

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

-1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V007-6991 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V007-6991 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-6991?
Check Price and Availability of V007-6991, 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 V007-6991 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-6991
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-6991
  • 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 V007-6991 available by request