5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(propylsulfanyl)-N-[(thiophen-2-yl)methyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(propylsulfanyl)-N-[(thiophen-2-yl)methyl]pyrimidine-4-carboxamide
5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(propylsulfanyl)-N-[(thiophen-2-yl)methyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0531 |
| Compound Name: | 5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(propylsulfanyl)-N-[(thiophen-2-yl)methyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 446.01 |
| Molecular Formula: | C17 H20 Cl N3 O3 S3 |
| Smiles: | CCCSc1ncc(c(C(N(Cc2cccs2)C2CCS(C2)(=O)=O)=O)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8437 |
| logD: | 2.8437 |
| logSw: | -3.2552 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.463 |
| InChI Key: | VOBWGLLSVCQQNQ-LBPRGKRZSA-N |