ethyl 4-(2-{[3-(4-chlorophenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[3-(4-chlorophenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[3-(4-chlorophenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | C250-0224 |
| Compound Name: | ethyl 4-(2-{[3-(4-chlorophenyl)-1,4-diazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 484.02 |
| Molecular Formula: | C25 H26 Cl N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1C(c2ccc(cc2)[Cl])=NC2(CCCCC2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5344 |
| logD: | 5.5343 |
| logSw: | -5.8283 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.984 |
| InChI Key: | ZWFJSZNPHVYVLD-UHFFFAOYSA-N |