5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)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-[(4-methoxyphenyl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D233-0780 |
Compound Name: | 5-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide |
Molecular Weight: | 470.01 |
Molecular Formula: | C20 H24 Cl N3 O4 S2 |
Smiles: | CC(C)Sc1ncc(c(C(N(Cc2ccc(cc2)OC)C2CCS(C2)(=O)=O)=O)n1)[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9267 |
logD: | 2.9267 |
logSw: | -3.3267 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 69.989 |
InChI Key: | FKTROVPBTXZFIJ-HNNXBMFYSA-N |