V018-6322 Screening compound: N-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-N-(2-methylpropyl)cyclopentanecarboxamide
Chemical Structure Depiction of ChemDiv screening compound V018-6322
N-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-N-(2-methylpropyl)cyclopentanecarboxamide
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
V018-6322
Molecular Formula
C25H32F3N3O3S (C25 H32 F3 N3 O3 S)
Compound Name
N-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-N-(2-methylpropyl)cyclopentanecarboxamide
IUPAC name
N-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-N-(2-methylpropyl)cyclopentanecarboxamide
SMILES
CC(C)CN(Cc(n1C2CC2)cnc1S(Cc1cc(C(F)(F)F)ccc1)(=O)=O)C(C1CCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
511.61
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.156
Distribution Coefficient, logD
5.156
Water Solubility, LogSw
-5.00
Polar Surface Area
58.328
Acid Dissociation Constant (pKa)
20.02
Base Dissociation Constant (pKb)
-0.91
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
60.00
V018-6322 in Drug Discovery
Included in Screening Libraries
KRAS-Targeted Library (16000 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Kinases
References: we are preparing a list of scientific research reports with V018-6322 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)