Succinamic acid, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-, propyl ester
Basic information
- CAS
107811-17-6- Standard SMILES
CCCOC(=O)CCC(=O)Nc1nnc(C(C)C)s1- InChIKey
RCPRRHCYPTZMOH-UHFFFAOYSA-N- Molecular formula
- C12H19N3O3S
- Average molar mass
- 285.36 g/mol
- Monoisotopic mass
- 285.11471265
Names & identifiers
- Preferred name
- Succinamic acid, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-, propyl ester
- IUPAC
- propyl 4-oxo-4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]butanoate
Names & synonyms
Succinamic acid, N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-, propyl ester107811-17-6DTXSID40148258N-(5-Isopropyl-1,3,4-thiadiazol-2-yl)succinamic acid propyl esterButanoic acid, 4-((5-(1-methylethyl)-1,3,4-thiadiazol-2-yl)amino)-4-oxo-, propyl esterRefChem:382350DTXCID9070749Propyl 4-oxo-4-{[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]amino}butanoate
Database identifiers
- CAS
107811-17-6- PubChem CID
- 3065352
- DTXSID
DTXSID40148258
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 313
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…