SC60-1004 Screening compound: 8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-6,6-dimethylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione

SC60-1004 Screening compound: 8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-6,6-dimethylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione
SC60-1004 Screening compound: 8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-6,6-dimethylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound SC60-1004
8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-6,6-dimethylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-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

SC60-1004

Molecular Formula

C21H35N3O4 (C21 H35 N3 O4)

Compound Name

8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-6,6-dimethylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione

IUPAC name

8-(3-cyclohexylpropanoyl)-2-(2-methoxyethyl)-66-dimethyl-octahydro-1H-imidazo[15-a][14]diazepine-13-dione

SMILES

CC(C)(CN(C(C1)C(N2CCOC)=O)C2=O)CN1C(CCC1CCCCC1)=O

InChI

InChI=1S/C21H35N3O4/c1-21(2)14-22(18(25)10-9-16-7-5-4-6-8-16)13-17-19(26)23(11-12-28-3)20(27)24(17)15-21/h16-17H,4-15H2,1-3H3/t17-/m1/s1

InChI Key

BLURUXXKXMJOPI-QGZVFWFLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.375

Distribution Coefficient, logD

2.375

Water Solubility, LogSw

-2.10

Polar Surface Area

57.802

Acid Dissociation Constant (pKa)

14.42

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

85.71

SC60-1004 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with SC60-1004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC60-1004?
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What is the minimum amount of SC60-1004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC60-1004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC60-1004
  • 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 SC60-1004 available by request