D434-0570 Screening compound: 4-[5-(butylamino)-4-cyano-1,3-oxazol-2-yl]-N,N-diethylbenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound D434-0570
4-[5-(butylamino)-4-cyano-1,3-oxazol-2-yl]-N,N-diethylbenzene-1-sulfonamide
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
D434-0570
Molecular Formula
C18H24N4O3S (C18 H24 N4 O3 S)
Compound Name
4-[5-(butylamino)-4-cyano-1,3-oxazol-2-yl]-N,N-diethylbenzene-1-sulfonamide
IUPAC name
4-[5-(butylamino)-4-cyano-13-oxazol-2-yl]-NN-diethylbenzene-1-sulfonamide
SMILES
CCCCNc1c(C#N)nc(-c(cc2)ccc2S(N(CC)CC)(=O)=O)o1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
376.48
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.320
Distribution Coefficient, logD
3.320
Water Solubility, LogSw
-3.65
Polar Surface Area
77.487
Acid Dissociation Constant (pKa)
17.18
Base Dissociation Constant (pKb)
-3.96
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.40
D434-0570 in Drug Discovery
Included in Screening Libraries
CNS MPO Library (28609 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with D434-0570 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)