methyl N-{4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzoyl}glycinate
Chemical Structure Depiction of
methyl N-{4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzoyl}glycinate
methyl N-{4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzoyl}glycinate
Compound characteristics
| Compound ID: | S480-0215 |
| Compound Name: | methyl N-{4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzoyl}glycinate |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C18 H21 N3 O7 S |
| Smiles: | COC(CNC(c1ccc(CN2C(C3(CCS(CC3)(=O)=O)NC2=O)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7541 |
| logD: | -0.7541 |
| logSw: | -2.0546 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.172 |
| InChI Key: | MCSYHLCPESUSAH-UHFFFAOYSA-N |