L329-0884 Screening compound: 6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-1,4-diazepan-1-yl]-1,3-bis(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

L329-0884 Screening compound: 6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-1,4-diazepan-1-yl]-1,3-bis(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
L329-0884 Screening compound: 6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-1,4-diazepan-1-yl]-1,3-bis(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L329-0884
6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-1,4-diazepan-1-yl]-1,3-bis(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

L329-0884

Molecular Formula

C24H33FN4O3S (C24 H33 FN4 O3 S)

Compound Name

6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-1,4-diazepan-1-yl]-1,3-bis(propan-2-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

6-[4-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetyl)-14-diazepan-1-yl]-13-bis(propan-2-yl)-1234-tetrahydropyrimidine-24-dione

SMILES

CC(C)N(C(C=C(N1C(C)C)N(CCC2)CCN2C(CSCc(cc2)ccc2F)=O)=O)C1=O

InChI

InChI=1S/C24H33FN4O3S/c1-17(2)28-21(14-22(30)29(18(3)4)24(28)32)26-10-5-11-27(13-12-26)23(31)16-33-15-19-6-8-20(25)9-7-19/h6-9,14,17-18H,5,10-13,15-16H2,1-4H3

InChI Key

BFQXVQLPWCRKTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27246502

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.338

Distribution Coefficient, logD

3.338

Water Solubility, LogSw

-3.57

Polar Surface Area

51.894

Acid Dissociation Constant (pKa)

23.00

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.20

L329-0884 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 L329-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L329-0884?
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What is the minimum amount of L329-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L329-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L329-0884
  • 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 L329-0884 available by request