Screening compound: MFCD31957712

Screening compound: MFCD31957712
Screening compound: MFCD31957712 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD31957712

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

ZC44-0154

Molecular Formula

C23H31N5O3 (C23 H31 N5 O3)

Compound Name

3-[4-(cyclohexylmethyl)-7-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane-1-carbonyl]benzoic acid

IUPAC name

3-[4-(cyclohexylmethyl)-7-(3-methyl-1H-124-triazol-5-yl)-14-diazepane-1-carbonyl]benzoic acid

SMILES

Cc1n[nH]c(C(CCN(CC2CCCCC2)CC2)N2C(c2cccc(C(O)=O)c2)=O)n1

InChI

InChI=1S/C23H31N5O3/c1-16-24-21(26-25-16)20-10-11-27(15-17-6-3-2-4-7-17)12-13-28(20)22(29)18-8-5-9-19(14-18)23(30)31/h5,8-9,14,17,20H,2-4,6-7,10-13,15H2,1H3,(H,30,31)(H,24,25,26)/t20-/m0/s1

InChI Key

KPGYAKUUDVQLAY-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD31957712

MFCD31957712 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with MFCD31957712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD31957712?
Check Price and Availability of MFCD31957712, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of MFCD31957712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD31957712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD31957712
  • 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 MFCD31957712 available by request