Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1CCC(C(=O)c2nc3ccccc3s2)CC1- InChIKey
PBTMGFWTRJQTNW-UHFFFAOYSA-N- Molecular formula
- C19H24N2O3S
- Average molar mass
- 360.5 g/mol
Names & identifiers
- Preferred name
- [4-(Benzothiazole-2-carbonyl)-cyclohexyl]-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[4-(1,3-benzothiazole-2-carbonyl)cyclohexyl]carbamate
Names & synonyms
SCHEMBL2207993SCHEMBL2209377PBTMGFWTRJQTNW-UHFFFAOYSA-N[4-(benzothiazole-2-carbonyl)-cyclohexyl]-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 67317166
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 497
Related reactions
2 records
Compound notes
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