4-bromo-2-[4-(4-ethylphenyl)-9-(propan-2-yl)-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]phenol
Chemical Structure Depiction of
4-bromo-2-[4-(4-ethylphenyl)-9-(propan-2-yl)-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]phenol
4-bromo-2-[4-(4-ethylphenyl)-9-(propan-2-yl)-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]phenol
Compound characteristics
| Compound ID: | K915-1573 |
| Compound Name: | 4-bromo-2-[4-(4-ethylphenyl)-9-(propan-2-yl)-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]phenol |
| Molecular Weight: | 470.45 |
| Molecular Formula: | C25 H32 Br N3 O |
| Smiles: | CCc1ccc(cc1)C1CC(c2cc(ccc2O)[Br])NC2(CCN(CC2)C(C)C)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8239 |
| logD: | 3.1009 |
| logSw: | -5.4405 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.391 |
| InChI Key: | KGFKASSXOOOKLS-QHCPKHFHSA-N |