V017-6493 Screening compound: N-(5-methyl-1,2-oxazol-3-yl)-2-[N-(3-methylbutyl)4-chloro-3-nitrobenzenesulfonamido]acetamide
Chemical Structure Depiction of ChemDiv screening compound V017-6493
N-(5-methyl-1,2-oxazol-3-yl)-2-[N-(3-methylbutyl)4-chloro-3-nitrobenzenesulfonamido]acetamide
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
V017-6493
Molecular Formula
C17H21ClN4O6S (C17 H21 ClN4 O6 S)
Compound Name
N-(5-methyl-1,2-oxazol-3-yl)-2-[N-(3-methylbutyl)4-chloro-3-nitrobenzenesulfonamido]acetamide
IUPAC name
N-(5-methyl-12-oxazol-3-yl)-2-[N-(3-methylbutyl)4-chloro-3-nitrobenzenesulfonamido]acetamide
SMILES
CC(C)CCN(CC(Nc1noc(C)c1)=O)S(c(cc1)cc([N+]([O-])=O)c1Cl)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
444.9
Hydrogen Bond Acceptors Count
13.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
4.128
Distribution Coefficient, logD
3.978
Water Solubility, LogSw
-4.43
Polar Surface Area
109.618
Acid Dissociation Constant (pKa)
7.78
Base Dissociation Constant (pKb)
-3.59
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
41.20
V017-6493 in Drug Discovery
Included in Screening Libraries
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Agro
References: we are preparing a list of scientific research reports with V017-6493 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)