4-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrazole-5-carbonyl)-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
Chemical Structure Depiction of
4-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrazole-5-carbonyl)-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
4-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrazole-5-carbonyl)-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
Compound characteristics
| Compound ID: | S588-0857 |
| Compound Name: | 4-[(3-fluorophenyl)methyl]-8-(1-methyl-1H-pyrazole-5-carbonyl)-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C19 H21 F N4 O3 S |
| Smiles: | Cn1c(ccn1)C(N1CCC2(CC1)N(Cc1cccc(c1)F)C(CS2=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7569 |
| logD: | 0.7569 |
| logSw: | -2.1107 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.96 |
| InChI Key: | XNTHRPVQNHBRLD-UHFFFAOYSA-N |