rel-(4aR,8aS)-N,N,1-trimethyl-6-[(5-methylthiophen-2-yl)methyl]-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Chemical Structure Depiction of
rel-(4aR,8aS)-N,N,1-trimethyl-6-[(5-methylthiophen-2-yl)methyl]-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
rel-(4aR,8aS)-N,N,1-trimethyl-6-[(5-methylthiophen-2-yl)methyl]-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide
Compound characteristics
| Compound ID: | S808-0318 |
| Compound Name: | rel-(4aR,8aS)-N,N,1-trimethyl-6-[(5-methylthiophen-2-yl)methyl]-2,2-dioxooctahydro-2lambda~6~-pyrido[4,3-c][1,2]thiazine-4a(2H)-carboxamide |
| Molecular Weight: | 385.55 |
| Molecular Formula: | C17 H27 N3 O3 S2 |
| Smiles: | [H][C@@]12CCN(Cc3ccc(C)s3)C[C@]1(CCS(N2C)(=O)=O)C(N(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8074 |
| logD: | 0.364 |
| logSw: | -2.0154 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.487 |
| InChI Key: | IATFOVIAMFCUCR-WBVHZDCISA-N |