V026-2132 Screening compound: N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of ChemDiv screening compound V026-2132
N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
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
V026-2132
Molecular Formula
C32H35ClN4O4S (C32 H35 ClN4 O4 S)
Compound Name
N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
IUPAC name
N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
SMILES
Cc1c(CS(c2ncc(CN(CCN3CCOCC3)C(c3cccc(Cl)c3)=O)n2Cc2ccccc2)(=O)=O)cccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
607.17
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.917
Distribution Coefficient, logD
4.911
Water Solubility, LogSw
-4.94
Polar Surface Area
68.460
Acid Dissociation Constant (pKa)
19.66
Base Dissociation Constant (pKb)
5.55
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
31.30
V026-2132 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 V026-2132 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)