Basic information
- CAS
300706-28-9- Standard SMILES
COc1cccc(NC(=S)N2CCOCC2)c1- InChIKey
CEJQDZXDKAVQPG-UHFFFAOYSA-N- Molecular formula
- C12H16N2O2S
- Average molar mass
- 252.33 g/mol
- Monoisotopic mass
- 252.09324893
Names & identifiers
- Preferred name
- N-(3-Methoxyphenyl)-4-morpholinecarbothioamide
- IUPAC
- N-(3-methoxyphenyl)morpholine-4-carbothioamide
Names & synonyms
300706-28-9N-(3-Methoxyphenyl)-4-morpholinecarbothioamideRefChem:361431N-(3-methoxyphenyl)morpholine-4-carbothioamideMaybridge1_003646HMS551N16DTXSID001249063STK144380AKOS002276644ST50166340AB00040596-01AB00040596-02
Show more names
4-Morpholinecarbothioamide, N-(3-methoxyphenyl)-[(3-methoxyphenyl)amino]morpholin-4-ylmethane-1-thioneF1533-0349
Database identifiers
- CAS
300706-28-9- PubChem CID
- 700010
- DTXSID
DTXSID001249063
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 257
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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