V004-2179 Screening compound: 4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound V004-2179
4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methyl-N-(4-methylphenyl)piperazine-1-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
V004-2179
Molecular Formula
C27H27FN4O2S (C27 H27 FN4 O2 S)
Compound Name
4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide
IUPAC name
4-{6-[(2-fluorophenyl)methyl]-6H-thieno[23-b]pyrrole-5-carbonyl}-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide
SMILES
CC(CN(CC1)C(c(n2Cc(cccc3)c3F)cc3c2scc3)=O)N1C(Nc1ccc(C)cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
490.6
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.646
Distribution Coefficient, logD
5.646
Water Solubility, LogSw
-5.70
Polar Surface Area
42.690
Acid Dissociation Constant (pKa)
14.35
Base Dissociation Constant (pKb)
2.47
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
25.90
References: we are preparing a list of scientific research reports with V004-2179 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)