4-benzyl-N-(3-bromophenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
4-benzyl-N-(3-bromophenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
4-benzyl-N-(3-bromophenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | V029-2539 |
| Compound Name: | 4-benzyl-N-(3-bromophenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 460.39 |
| Molecular Formula: | C21 H22 Br N3 O2 S |
| Smiles: | C1CN(CCC12N(Cc1ccccc1)C(CS2)=O)C(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2225 |
| logD: | 4.2225 |
| logSw: | -4.2794 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42 |
| InChI Key: | HDSPCQRAVQQQGV-UHFFFAOYSA-N |