3-[2-(adamantan-1-yl)ethyl]-N-(2-chlorophenyl)-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[2-(adamantan-1-yl)ethyl]-N-(2-chlorophenyl)-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
3-[2-(adamantan-1-yl)ethyl]-N-(2-chlorophenyl)-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 8012-9125 |
| Compound Name: | 3-[2-(adamantan-1-yl)ethyl]-N-(2-chlorophenyl)-2-[(4-chlorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 556.55 |
| Molecular Formula: | C29 H31 Cl2 N3 O2 S |
| Smiles: | C1C2CC3CC1CC(CCN1\C(=N/c4ccc(cc4)[Cl])SC(CC1=O)C(Nc1ccccc1[Cl])=O)(C2)C3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3572 |
| logD: | 7.3569 |
| logSw: | -6.4624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.452 |
| InChI Key: | ZFRPTFCGPZKBNQ-CHYBTZLKSA-N |