L057-1598 Screening compound: methyl 2-[({[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate

L057-1598 Screening compound: methyl 2-[({[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate
L057-1598 Screening compound: methyl 2-[({[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L057-1598
methyl 2-[({[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate

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

L057-1598

Molecular Formula

C27H27N3O5 (C27 H27 N3 O5)

Compound Name

methyl 2-[({[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate

IUPAC name

methyl 2-[({[1-(4-methoxybenzoyl)-23-dihydro-1H-indol-6-yl]methyl}carbamoyl)amino]-4-methylbenzoate

SMILES

Cc(cc1)cc(NC(NCc2cc(N(CC3)C(c(cc4)ccc4OC)=O)c3cc2)=O)c1C(OC)=O

InChI

InChI=1S/C27H27N3O5/c1-17-4-11-22(26(32)35-3)23(14-17)29-27(33)28-16-18-5-6-19-12-13-30(24(19)15-18)25(31)20-7-9-21(34-2)10-8-20/h4-11,14-15H,12-13,16H2,1-3H3,(H2,28,29,33)

InChI Key

PUUDLZSBLCADRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.678

Distribution Coefficient, logD

3.677

Water Solubility, LogSw

-3.88

Polar Surface Area

77.562

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

-1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

L057-1598 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L057-1598 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L057-1598?
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What is the minimum amount of L057-1598 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L057-1598
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L057-1598
  • 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 L057-1598 available by request