7-benzyl-11-(1-methyl-1H-pyrazole-3-carbonyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
Chemical Structure Depiction of
7-benzyl-11-(1-methyl-1H-pyrazole-3-carbonyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
7-benzyl-11-(1-methyl-1H-pyrazole-3-carbonyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
Compound characteristics
| Compound ID: | SB80-0475 |
| Compound Name: | 7-benzyl-11-(1-methyl-1H-pyrazole-3-carbonyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one |
| Molecular Weight: | 437.58 |
| Molecular Formula: | C25 H35 N5 O2 |
| Smiles: | Cn1ccc(C(N2CCCN(Cc3ccccc3)C3(CCCCC3)CC(NCC2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8112 |
| logD: | 1.2418 |
| logSw: | -2.1227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.041 |
| InChI Key: | KLVRGXKBXZYWSF-UHFFFAOYSA-N |