Basic information
- Standard SMILES
CC(C)(C)NCC(O)COc1ncc(C(=O)NCCC2C3CCC2CC3)s1- InChIKey
MABKVHHLVVDNBY-UHFFFAOYSA-N- Molecular formula
- C20H33N3O3S
- Average molar mass
- 395.6 g/mol
Names & identifiers
- Preferred name
- 1-t-Butylamino-3-(5-[2-(bicyclo[2.2.1]hept-7-yl)ethylaminocarbonyl]thiazol-2-yloxy)propan-2-ol
- IUPAC
- N-[2-(7-bicyclo[2.2.1]heptanyl)ethyl]-2-[3-(tert-butylamino)-2-hydroxypropoxy]-1,3-thiazole-5-carboxamide
Names & synonyms
SCHEMBL11712953MABKVHHLVVDNBY-UHFFFAOYSA-N1-t-butylamino-3-(5-[2-(bicyclo[2.2.1]-hept-7-yl)ethylaminocarbonyl]thiazol-2-yloxy)-propan-2-ol1-t-butylamino-3-(5-[2-(bicyclo[2.2.1]hept-7-yl)ethylaminocarbonyl]thiazol-2-yloxy)propan-2-ol
Database identifiers
- PubChem CID
- 21391853
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 479
Related reactions
4 records
Compound notes
Loading…