Cycloheptanamine, N-ethyl-4-(1-methylethyl)-1-[4-(1-methylethyl)-2-thiazolyl]-
Basic information
- CAS
1496760-00-9- Standard SMILES
CCNC1(c2nc(C(C)C)cs2)CCCC(C(C)C)CC1- InChIKey
QNNLMNYDNJQRBS-UHFFFAOYSA-N- Molecular formula
- C18H32N2S
- Average molar mass
- 308.5 g/mol
- Monoisotopic mass
- 308.2286202
Names & identifiers
- Preferred name
- Cycloheptanamine, N-ethyl-4-(1-methylethyl)-1-[4-(1-methylethyl)-2-thiazolyl]-
- IUPAC
- N-ethyl-4-propan-2-yl-1-(4-propan-2-yl-1,3-thiazol-2-yl)cycloheptan-1-amine
Names & synonyms
DTXSID201137056AKOS014422039Cycloheptanamine, N-ethyl-4-(1-methylethyl)-1-[4-(1-methylethyl)-2-thiazolyl]-N-Ethyl-4-(propan-2-yl)-1-[4-(propan-2-yl)-1,3-thiazol-2-yl]cycloheptan-1-amine1496760-00-9
Database identifiers
- CAS
1496760-00-9- PubChem CID
- 65089179
- DTXSID
DTXSID201137056
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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