V018-1497 Screening compound: ethyl 4-[({2-[4-(4-chlorophenyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate

V018-1497 Screening compound: ethyl 4-[({2-[4-(4-chlorophenyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate
V018-1497 Screening compound: ethyl 4-[({2-[4-(4-chlorophenyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-1497
ethyl 4-[({2-[4-(4-chlorophenyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate

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

V018-1497

Molecular Formula

C32H29ClN4O4 (C32 H29 ClN4 O4)

Compound Name

ethyl 4-[({2-[4-(4-chlorophenyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate

IUPAC name

ethyl 4-[({2-[4-(4-chlorophenyl)-4H5H-pyrrolo[12-a]quinoxalin-5-yl]-2-oxoethyl}(cyclopropyl)carbamoyl)amino]benzoate

SMILES

CCOC(c(cc1)ccc1NC(N(CC(N(C1c(cc2)ccc2Cl)c(cccc2)c2-n2c1ccc2)=O)C1CC1)=O)=O

InChI

InChI=1S/C32H29ClN4O4/c1-2-41-31(39)22-11-15-24(16-12-22)34-32(40)36(25-17-18-25)20-29(38)37-27-7-4-3-6-26(27)35-19-5-8-28(35)30(37)21-9-13-23(33)14-10-21/h3-16,19,25,30H,2,17-18,20H2,1H3,(H,34,40)/t30-/m1/s1

InChI Key

RNKRQLOVUBRXTA-SSEXGKCCSA-N

MDL Number (MFCD)

MFCD14239466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

569.06

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.648

Distribution Coefficient, logD

6.648

Water Solubility, LogSw

-6.44

Polar Surface Area

60.910

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.90

V018-1497 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V018-1497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-1497?
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What is the minimum amount of V018-1497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-1497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-1497
  • 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 V018-1497 available by request