Basic information
- CAS
107811-33-6- Standard SMILES
C=CCNC(=O)CCC(=O)Nc1nnc(C(C)C)s1- InChIKey
QVKDOZYBVZRYKD-UHFFFAOYSA-N- Molecular formula
- C12H18N4O2S
- Average molar mass
- 282.36 g/mol
- Monoisotopic mass
- 282.115047
Names & identifiers
- Preferred name
- Succinamide, N-allyl-N'-(5-isopropyl-1,3,4-thiadiazol-2-yl)-
- IUPAC
- N'-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-N-prop-2-enylbutanediamide
Names & synonyms
Succinamide, N-allyl-N'-(5-isopropyl-1,3,4-thiadiazol-2-yl)-N-Allyl-N'-(5-isopropyl-1,3,4-thiadiazol-2-yl)succinamide107811-33-6DTXSID20148271Butanediamide, N-(5-(1-methylethyl)-1,3,4-thiadiazol-2-yl)-N'-2-propenyl-RefChem:382362DTXCID2070762N~1~-[5-(Propan-2-yl)-1,3,4-thiadiazol-2-yl]-N~4~-(prop-2-en-1-yl)butanediamide
Database identifiers
- CAS
107811-33-6- PubChem CID
- 3065367
- DTXSID
DTXSID20148271
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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