ethyl 4-{2-[(3-phenyl-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(3-phenyl-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(3-phenyl-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | C250-0225 |
| Compound Name: | ethyl 4-{2-[(3-phenyl-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1C(c2ccccc2)=NC2(CCCCC2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8346 |
| logD: | 4.8345 |
| logSw: | -4.4168 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.984 |
| InChI Key: | FOBAJLJOWFAJGR-UHFFFAOYSA-N |