G545-0284 Screening compound: 3-{[(4-ethoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide
Chemical Structure Depiction of ChemDiv screening compound G545-0284
3-{[(4-ethoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide
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
G545-0284
Molecular Formula
C28H32N4O4 (C28 H32 N4 O4)
Compound Name
3-{[(4-ethoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide
IUPAC name
3-{[(4-ethoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide
SMILES
CCOc(cc1)ccc1NC(Nc(cc(cc1)C(NCc(cc2)ccc2OC)=O)c1N1CCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
488.59
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
5.343
Distribution Coefficient, logD
5.343
Water Solubility, LogSw
-5.30
Polar Surface Area
74.442
Acid Dissociation Constant (pKa)
10.40
Base Dissociation Constant (pKb)
8.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.60
G545-0284 in Drug Discovery
Included in Screening Libraries
Eccentric PPI Library (11937 compounds)
Protein-Protein Interaction Library (218420 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with G545-0284 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)