N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(4-methoxyphenoxy)acetamide
Basic information
- CAS
380321-51-7- Standard SMILES
COc1ccc(OCC(=O)Nc2nc3cc4c(cc3s2)OCCO4)cc1- InChIKey
VFBDQOJTHJYUJV-UHFFFAOYSA-N- Molecular formula
- C18H16N2O5S
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 372.07799279
Names & identifiers
- Preferred name
- N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(4-methoxyphenoxy)acetamide
- IUPAC
- N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(4-methoxyphenoxy)acetamide
Names & synonyms
N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(4-methoxyphenoxy)acetamideOprea1_136627MLS002249555CHEMBL1476805DTXSID001325825HMS3084F22AKOS024922072380321-51-7SMR001316983Z56817922F1822-0996N-(6,7-Dihydro[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(4-methoxyphenoxy)acetamide
Show more names
N-(6,7-dihydro-[1,4]dioxino[2',3':4,5]benzo[1,2-d]thiazol-2-yl)-2-(4-methoxyphenoxy)acetamide
Database identifiers
- CAS
380321-51-7- PubChem CID
- 2382005
- DTXSID
DTXSID001325825- ChEMBL
CHEMBL1476805
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 488
Experimental & physicochemical properties
Solubility4.6 [ug/mL] (The mean of the results at pH 7.4)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…