L329-0850 Screening compound: N-(4-{4-[2,6-dioxo-1,3-bis(propan-2-yl)-1,2,3,6-tetrahydropyrimidin-4-yl]-1,4-diazepane-1-carbonyl}phenyl)acetamide

L329-0850 Screening compound: N-(4-{4-[2,6-dioxo-1,3-bis(propan-2-yl)-1,2,3,6-tetrahydropyrimidin-4-yl]-1,4-diazepane-1-carbonyl}phenyl)acetamide
L329-0850 Screening compound: N-(4-{4-[2,6-dioxo-1,3-bis(propan-2-yl)-1,2,3,6-tetrahydropyrimidin-4-yl]-1,4-diazepane-1-carbonyl}phenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L329-0850
N-(4-{4-[2,6-dioxo-1,3-bis(propan-2-yl)-1,2,3,6-tetrahydropyrimidin-4-yl]-1,4-diazepane-1-carbonyl}phenyl)acetamide

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

L329-0850

Molecular Formula

C24H33N5O4 (C24 H33 N5 O4)

Compound Name

N-(4-{4-[2,6-dioxo-1,3-bis(propan-2-yl)-1,2,3,6-tetrahydropyrimidin-4-yl]-1,4-diazepane-1-carbonyl}phenyl)acetamide

IUPAC name

N-(4-{4-[26-dioxo-13-bis(propan-2-yl)-1236-tetrahydropyrimidin-4-yl]-14-diazepane-1-carbonyl}phenyl)acetamide

SMILES

CC(C)N(C(C=C(N1C(C)C)N(CCC2)CCN2C(c(cc2)ccc2NC(C)=O)=O)=O)C1=O

InChI

InChI=1S/C24H33N5O4/c1-16(2)28-21(15-22(31)29(17(3)4)24(28)33)26-11-6-12-27(14-13-26)23(32)19-7-9-20(10-8-19)25-18(5)30/h7-10,15-17H,6,11-14H2,1-5H3,(H,25,30)

InChI Key

RALDOXJAINMVLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27246483

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.793

Distribution Coefficient, logD

1.793

Water Solubility, LogSw

-2.29

Polar Surface Area

75.683

Acid Dissociation Constant (pKa)

10.78

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

L329-0850 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L329-0850 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L329-0850?
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What is the minimum amount of L329-0850 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L329-0850
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L329-0850
  • 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 L329-0850 available by request