Basic information
- Standard SMILES
CC(C)c1nc(C(=O)N2CCOC3(CCN(Cc4cccc(CCO)c4Cl)CC3)C2)cs1- InChIKey
HPBOLDVLAPJGDV-UHFFFAOYSA-N- Molecular formula
- C24H32ClN3O3S
- Average molar mass
- 478 g/mol
Names & identifiers
- Preferred name
- (9-(2-Chloro-3-(2-hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)(2-isopropylthiazol-4-yl)methanone
- IUPAC
- [9-[[2-chloro-3-(2-hydroxyethyl)phenyl]methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-(2-propan-2-yl-1,3-thiazol-4-yl)methanone
Names & synonyms
SCHEMBL1246649HPBOLDVLAPJGDV-UHFFFAOYSA-N(9-(2-Chloro-3-(2-hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)(2-isopropylthiazol-4-yl)methanone
Database identifiers
- PubChem CID
- 46240302
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 632
Related reactions
8 records
Compound notes
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