G118-1927 Screening compound: 4-(3-chlorophenyl)-N~5~-(5,6,7,8-tetrahydro-1-naphthalenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G118-1927
4-(3-chlorophenyl)-N~5~-(5,6,7,8-tetrahydro-1-naphthalenyl)-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
G118-1927
Molecular Formula
C29H26ClN3O (C29 H26 ClN3 O)
Compound Name
4-(3-chlorophenyl)-N~5~-(5,6,7,8-tetrahydro-1-naphthalenyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
IUPAC name
7-(3-chlorophenyl)-N-(5678-tetrahydronaphthalen-1-yl)-28-diazatricyclo[8.4.0.0^{26}]tetradeca-1(10)351113-pentaene-8-carboxamide
SMILES
O=C(Nc1c(CCCC2)c2ccc1)N(Cc(cccc1)c1-n1c2ccc1)C2c1cccc(Cl)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
468
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
7.795
Distribution Coefficient, logD
7.795
Water Solubility, LogSw
-6.53
Polar Surface Area
25.794
Acid Dissociation Constant (pKa)
15.23
Base Dissociation Constant (pKb)
0.43
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
20.70
G118-1927 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Protein-Protein Interaction Library (218420 compounds)
Epigenetics Focused Set (26518 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Kinases
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with G118-1927 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)