C928-0456 Screening compound: N-{2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound C928-0456
N-{2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethyl}-5,6,7,8-tetrahydronaphthalene-2-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
C928-0456
Molecular Formula
C23H26N2O4S2 (C23 H26 N2 O4 S2)
Compound Name
N-{2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
IUPAC name
N-{2-[2-(34-dimethoxyphenyl)-13-thiazol-4-yl]ethyl}-5678-tetrahydronaphthalene-2-sulfonamide
SMILES
COc(ccc(-c1nc(CCNS(c2cc(CCCC3)c3cc2)(=O)=O)cs1)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
458.6
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.227
Distribution Coefficient, logD
5.227
Water Solubility, LogSw
-5.15
Polar Surface Area
67.249
Acid Dissociation Constant (pKa)
10.92
Base Dissociation Constant (pKb)
1.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
34.80
C928-0456 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
References: we are preparing a list of scientific research reports with C928-0456 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)