V002-1380 Screening compound: 1-cyclopropanecarbonyl-4-(2,3-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound V002-1380
1-cyclopropanecarbonyl-4-(2,3-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]pyrrolidine-3-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
V002-1380
Molecular Formula
C24H27FN2O4 (C24 H27 FN2 O4)
Compound Name
1-cyclopropanecarbonyl-4-(2,3-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]pyrrolidine-3-carboxamide
IUPAC name
1-cyclopropanecarbonyl-4-(23-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]pyrrolidine-3-carboxamide
SMILES
COc1cccc(C(CN(C2)C(C3CC3)=O)C2C(NCc(cc2)ccc2F)=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
426.49
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.755
Distribution Coefficient, logD
2.755
Water Solubility, LogSw
-3.07
Polar Surface Area
57.132
Acid Dissociation Constant (pKa)
11.47
Base Dissociation Constant (pKb)
1.46
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
41.70
V002-1380 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Inhibitors of beta-Catenin Signaling (7445 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Hemic and lymphatic
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with V002-1380 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)