F347-0063 Screening compound: ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate

F347-0063 Screening compound: ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
F347-0063 Screening compound: ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F347-0063
ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate

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

F347-0063

Molecular Formula

C28H31N3O4 (C28 H31 N3 O4)

Compound Name

ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 5-{[1-(6-methoxy-1H-indol-2-yl)-N-[(4-methylphenyl)methyl]formamido]methyl}-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(CN(Cc2ccc(C)cc2)C(c2cc(ccc(OC)c3)c3[nH]2)=O)c1C)=O

InChI

InChI=1S/C28H31N3O4/c1-6-35-28(33)26-18(3)25(29-19(26)4)16-31(15-20-9-7-17(2)8-10-20)27(32)24-13-21-11-12-22(34-5)14-23(21)30-24/h7-14,29-30H,6,15-16H2,1-5H3

InChI Key

UVMNURGYYADBRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14951366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.425

Distribution Coefficient, logD

5.425

Water Solubility, LogSw

-5.84

Polar Surface Area

65.301

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

-3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

F347-0063 in Drug Discovery

Included in Screening Libraries

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

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with F347-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F347-0063?
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What is the minimum amount of F347-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F347-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F347-0063
  • 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 F347-0063 available by request