5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0794 |
| Compound Name: | 5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 429.94 |
| Molecular Formula: | C17 H20 Cl N3 O4 S2 |
| Smiles: | CC(C)Sc1ncc(c(C(N(Cc2ccco2)C2CCS(C2)(=O)=O)=O)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5133 |
| logD: | 2.5133 |
| logSw: | -2.8908 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.194 |
| InChI Key: | MBNIKKUHKCLCMU-LBPRGKRZSA-N |