K623-0741 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide

K623-0741 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide
K623-0741 Screening compound: N~1~-(5-chloro-2-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K623-0741
N~1~-(5-chloro-2-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide

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

K623-0741

Molecular Formula

C34H33ClN4O5 (C34 H33 ClN4 O5)

Compound Name

N~1~-(5-chloro-2-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide

IUPAC name

N-(5-chloro-2-methylphenyl)-3-(35-dimethoxybenzamido)-4-{6-oxo-711-diazatricyclo[7.3.1.0^{27}]trideca-24-dien-11-yl}benzamide

SMILES

Cc(ccc(Cl)c1)c1NC(c(cc1)cc(NC(c2cc(OC)cc(OC)c2)=O)c1N(CC(C1)CN23)CC1C3=CC=CC2=O)=O

InChI

InChI=1S/C34H33ClN4O5/c1-20-7-9-25(35)15-28(20)36-33(41)22-8-10-31(29(14-22)37-34(42)23-12-26(43-2)16-27(13-23)44-3)38-17-21-11-24(19-38)30-5-4-6-32(40)39(30)18-21/h4-10,12-16,21,24H,11,17-19H2,1-3H3,(H,36,41)(H,37,42)

InChI Key

WGTJGQSDLLZZAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15093429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

613.11

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.163

Distribution Coefficient, logD

6.111

Water Solubility, LogSw

-6.19

Polar Surface Area

78.963

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

-0.11

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

26.50

K623-0741 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K623-0741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K623-0741?
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What is the minimum amount of K623-0741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K623-0741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K623-0741
  • 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 K623-0741 available by request