G118-1520 Screening compound: 4-(3,4-dimethoxyphenyl)-N~5~-(2-methoxy-5-methylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide

G118-1520 Screening compound: 4-(3,4-dimethoxyphenyl)-N~5~-(2-methoxy-5-methylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
G118-1520 Screening compound: 4-(3,4-dimethoxyphenyl)-N~5~-(2-methoxy-5-methylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G118-1520
4-(3,4-dimethoxyphenyl)-N~5~-(2-methoxy-5-methylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide

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

G118-1520

Molecular Formula

C29H29N3O4 (C29 H29 N3 O4)

Compound Name

4-(3,4-dimethoxyphenyl)-N~5~-(2-methoxy-5-methylphenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide

IUPAC name

7-(34-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-28-diazatricyclo[8.4.0.0^{26}]tetradeca-1(10)351113-pentaene-8-carboxamide

SMILES

Cc(cc1)cc(NC(N(Cc(cccc2)c2-n2c3ccc2)C3c(cc2)cc(OC)c2OC)=O)c1OC

InChI

InChI=1S/C29H29N3O4/c1-19-11-13-25(34-2)22(16-19)30-29(33)32-18-21-8-5-6-9-23(21)31-15-7-10-24(31)28(32)20-12-14-26(35-3)27(17-20)36-4/h5-17,28H,18H2,1-4H3,(H,30,33)/t28-/m1/s1

InChI Key

CFIBWPHFTCJXPX-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD27209770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.656

Distribution Coefficient, logD

5.656

Water Solubility, LogSw

-5.45

Polar Surface Area

48.764

Acid Dissociation Constant (pKa)

13.56

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.70

G118-1520 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Developmental Pathway (Hh/Wnt) Set (2238 compounds)

Epigenetics Focused Set (26518 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G118-1520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G118-1520?
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What is the minimum amount of G118-1520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G118-1520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G118-1520
  • 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 G118-1520 available by request