D337-1302 Screening compound: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D337-1302
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide
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
D337-1302
Molecular Formula
C15H11N3O4S (C15 H11 N3 O4 S)
Compound Name
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide
IUPAC name
5-(23-dihydro-14-benzodioxin-6-yl)-N-(13-thiazol-2-yl)-12-oxazole-3-carboxamide
SMILES
O=C(c1noc(-c(cc2)cc3c2OCCO3)c1)Nc1nccs1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
329.34
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.064
Distribution Coefficient, logD
2.063
Water Solubility, LogSw
-2.96
Polar Surface Area
71.166
Acid Dissociation Constant (pKa)
10.07
Base Dissociation Constant (pKb)
0.38
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
D337-1302 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Angiogenesis library (14822 compounds)
Anti-Aging Library (44940 compounds)
Antimitotic Tubulin Library (17355 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
- Epigenetic
References: we are preparing a list of scientific research reports with D337-1302 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)