Basic information
- Standard SMILES
Nc1nnc(NCCCOc2cccc(CN3CCOCC3)c2)s1- InChIKey
UZKWITPYCDKUMW-UHFFFAOYSA-N- Molecular formula
- C16H23N5O2S
- Average molar mass
- 349.5 g/mol
Names & identifiers
- Preferred name
- N-[3-[3-(4-Morpholinylmethyl)phenoxy]propyl]-1,3,4-thiadiazole-2.5-diamine
- IUPAC
- 2-N-[3-[3-(morpholin-4-ylmethyl)phenoxy]propyl]-1,3,4-thiadiazole-2,5-diamine
Names & synonyms
SCHEMBL10673289UZKWITPYCDKUMW-UHFFFAOYSA-NN-[3-[3-(4-Morpholinylmethyl)phenoxy]propyl]-1,3,4-thiadiazole-2.5-diamine
Database identifiers
- PubChem CID
- 20151483
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 359
Related reactions
1 records
Compound notes
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