V003-2983 Screening compound: 1-[4-(3-methoxyphenyl)-1-(4-methylbenzoyl)pyrrolidine-3-carbonyl]-4-(2-methylphenyl)piperazine
Chemical Structure Depiction of ChemDiv screening compound V003-2983
1-[4-(3-methoxyphenyl)-1-(4-methylbenzoyl)pyrrolidine-3-carbonyl]-4-(2-methylphenyl)piperazine
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
V003-2983
Molecular Formula
C31H35N3O3 (C31 H35 N3 O3)
Compound Name
1-[4-(3-methoxyphenyl)-1-(4-methylbenzoyl)pyrrolidine-3-carbonyl]-4-(2-methylphenyl)piperazine
IUPAC name
1-[4-(3-methoxyphenyl)-1-(4-methylbenzoyl)pyrrolidine-3-carbonyl]-4-(2-methylphenyl)piperazine
SMILES
Cc(cc1)ccc1C(N(CC1C(N(CC2)CCN2c2c(C)cccc2)=O)CC1c1cc(OC)ccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
497.64
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.997
Distribution Coefficient, logD
4.997
Water Solubility, LogSw
-4.63
Polar Surface Area
43.999
Acid Dissociation Constant (pKa)
21.09
Base Dissociation Constant (pKb)
4.83
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
35.50
V003-2983 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Inhibitors of beta-Catenin Signaling (7445 compounds)
Included in 1.7M Stock Database
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with V003-2983 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)