D400-5972 Screening compound: 4-methoxy-N-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-phenylbenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound D400-5972
4-methoxy-N-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-phenylbenzene-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
D400-5972
Molecular Formula
C17H17N3O4S (C17 H17 N3 O4 S)
Compound Name
4-methoxy-N-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-phenylbenzene-1-sulfonamide
IUPAC name
4-methoxy-N-methyl-3-(5-methyl-124-oxadiazol-3-yl)-N-phenylbenzene-1-sulfonamide
SMILES
Cc1nc(-c(cc(cc2)S(N(C)c3ccccc3)(=O)=O)c2OC)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
359.41
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.172
Distribution Coefficient, logD
3.172
Water Solubility, LogSw
-3.52
Polar Surface Area
71.595
Acid Dissociation Constant (pKa)
29.13
Base Dissociation Constant (pKb)
-4.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.60
D400-5972 in Drug Discovery
Included in Screening Libraries
Antimitotic Tubulin Library (17355 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
References: we are preparing a list of scientific research reports with D400-5972 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)