V007-2054 Screening compound: 3-chloro-N-{2-[1-(3-fluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxoethyl}-2,2-dimethyl-N-propylpropanamide

V007-2054 Screening compound: 3-chloro-N-{2-[1-(3-fluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxoethyl}-2,2-dimethyl-N-propylpropanamide
V007-2054 Screening compound: 3-chloro-N-{2-[1-(3-fluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxoethyl}-2,2-dimethyl-N-propylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-2054
3-chloro-N-{2-[1-(3-fluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxoethyl}-2,2-dimethyl-N-propylpropanamide

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

V007-2054

Molecular Formula

C23H29ClFN3O2 (C23 H29 ClFN3 O2)

Compound Name

3-chloro-N-{2-[1-(3-fluorophenyl)-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazin-2-yl]-2-oxoethyl}-2,2-dimethyl-N-propylpropanamide

IUPAC name

3-chloro-N-{2-[1-(3-fluorophenyl)-1H2H3H4H-pyrrolo[12-a]pyrazin-2-yl]-2-oxoethyl}-22-dimethyl-N-propylpropanamide

SMILES

CCCN(CC(N(CCn1c2ccc1)C2c1cc(F)ccc1)=O)C(C(C)(C)CCl)=O

InChI

InChI=1S/C23H29ClFN3O2/c1-4-10-27(22(30)23(2,3)16-24)15-20(29)28-13-12-26-11-6-9-19(26)21(28)17-7-5-8-18(25)14-17/h5-9,11,14,21H,4,10,12-13,15-16H2,1-3H3/t21-/m1/s1

InChI Key

SRQSJWVDPMAKJJ-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14431352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.95

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.408

Distribution Coefficient, logD

4.408

Water Solubility, LogSw

-4.17

Polar Surface Area

34.566

Acid Dissociation Constant (pKa)

25.17

Base Dissociation Constant (pKb)

-2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with V007-2054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-2054?
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What is the minimum amount of V007-2054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-2054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-2054
  • 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 V007-2054 available by request