V027-4875 Screening compound: N3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-N1-ethylpyrrolidine-1,3-dicarboxamide
Chemical Structure Depiction of ChemDiv screening compound V027-4875
N3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-N1-ethylpyrrolidine-1,3-dicarboxamide
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
V027-4875
Molecular Formula
C24H29N3O6 (C24 H29 N3 O6)
Compound Name
N3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2,4-dimethoxyphenyl)-N1-ethylpyrrolidine-1,3-dicarboxamide
IUPAC name
N3-[(2H-13-benzodioxol-5-yl)methyl]-4-(24-dimethoxyphenyl)-N1-ethylpyrrolidine-13-dicarboxamide
SMILES
CCNC(N(CC1C(NCc(cc2)cc3c2OCO3)=O)CC1c(ccc(OC)c1)c1OC)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
455.51
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.483
Distribution Coefficient, logD
2.483
Water Solubility, LogSw
-2.97
Polar Surface Area
83.591
Acid Dissociation Constant (pKa)
13.39
Base Dissociation Constant (pKb)
1.06
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
41.70
V027-4875 in Drug Discovery
Included in Screening Libraries
Inhibitors of beta-Catenin Signaling (7445 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with V027-4875 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)