V028-2695 Screening compound: 2-[N-benzyl-1-(2-methylphenyl)formamido]-N-[4-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1H-imidazol-2-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound V028-2695
2-[N-benzyl-1-(2-methylphenyl)formamido]-N-[4-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1H-imidazol-2-yl]acetamide
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
V028-2695
Molecular Formula
C34H31ClN4O2 (C34 H31 ClN4 O2)
Compound Name
2-[N-benzyl-1-(2-methylphenyl)formamido]-N-[4-(4-chlorophenyl)-1-(3,4-dimethylphenyl)-1H-imidazol-2-yl]acetamide
IUPAC name
2-[N-benzyl-1-(2-methylphenyl)formamido]-N-[4-(4-chlorophenyl)-1-(34-dimethylphenyl)-1H-imidazol-2-yl]acetamide
SMILES
Cc(cc1)c(C)cc1-n1c(NC(CN(Cc2ccccc2)C(c2c(C)cccc2)=O)=O)nc(-c(cc2)ccc2Cl)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
563.1
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
8.017
Distribution Coefficient, logD
8.017
Water Solubility, LogSw
-6.30
Polar Surface Area
52.393
Acid Dissociation Constant (pKa)
13.82
Base Dissociation Constant (pKb)
3.46
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
14.70
V028-2695 in Drug Discovery
Included in Screening Libraries
MCL1 Targeted Library (12200 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with V028-2695 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)