(4-tert-butylphenyl)(8-methyl-3-phenyl-2-sulfanylidene-1,4,8-triazaspiro[4.5]dec-3-en-1-yl)methanone
Chemical Structure Depiction of
(4-tert-butylphenyl)(8-methyl-3-phenyl-2-sulfanylidene-1,4,8-triazaspiro[4.5]dec-3-en-1-yl)methanone
(4-tert-butylphenyl)(8-methyl-3-phenyl-2-sulfanylidene-1,4,8-triazaspiro[4.5]dec-3-en-1-yl)methanone
Compound characteristics
| Compound ID: | C915-0124 |
| Compound Name: | (4-tert-butylphenyl)(8-methyl-3-phenyl-2-sulfanylidene-1,4,8-triazaspiro[4.5]dec-3-en-1-yl)methanone |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C25 H29 N3 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N1C(C(c2ccccc2)=NC12CCN(C)CC2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4725 |
| logD: | 1.8619 |
| logSw: | -4.2138 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 27.2815 |
| InChI Key: | PFOLCACZOSDJBA-UHFFFAOYSA-N |